data_19850 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 19850 _Entry.Title ; NMR-based docking model of GrxS14-BolA2 apo-heterodimer from Arabidopsis thaliana ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2014-03-13 _Entry.Accession_date 2014-03-13 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 THOMAS RORET . . . 19850 2 PASCALE TSAN . . . 19850 3 JEREMY COUTURIER . . . 19850 4 NICOLAS ROUHIER . . . 19850 5 CLAUDE DIDIERJEAN . . . 19850 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'not applicable' 'not applicable' . 19850 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID Apo-heterodimer . 19850 'Arabidopsis thaliana' . 19850 BolA . 19850 Glutaredoxin . 19850 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 4 19850 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '1H chemical shifts' 356 19850 '15N chemical shifts' 356 19850 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2014-09-29 2014-03-13 update BMRB 'update entry citation' 19850 1 . . 2014-07-21 2014-03-13 original author 'original release' 19850 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 19849 'Reduced BolA2 from Arabidopsis thaliana' 19850 PDB 2mma 'BMRB Entry Tracking System' 19850 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 19850 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI 10.1074/jbc.M114.572701 _Citation.PubMed_ID 25012657 _Citation.Full_citation . _Citation.Title 'Structural and Spectroscopic Insights into BolA-Glutaredoxin Complexes.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biol. Chem.' _Citation.Journal_name_full 'The Journal of biological chemistry' _Citation.Journal_volume 289 _Citation.Journal_issue 35 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1083-351X _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 24588 _Citation.Page_last 24598 _Citation.Year 2014 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Thomas Roret T. . . 19850 1 2 Pascale Tsan P. . . 19850 1 3 Jeremy Couturier J. . . 19850 1 4 Bo Zhang B. . . 19850 1 5 Michael Johnson M. K. . 19850 1 6 Nicolas Rouhier N. . . 19850 1 7 Claude Didierjean C. . . 19850 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 19850 _Assembly.ID 1 _Assembly.Name 'GrxS14-BolA2 apo-heterodimer from Arabidopsis thaliana' _Assembly.BMRB_code . _Assembly.Number_of_components 2 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 GrxS14 1 $GrxS14 A . yes native no no . . . 19850 1 2 BolA2 2 $BolA2 B . yes native no no . . . 19850 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_GrxS14 _Entity.Sf_category entity _Entity.Sf_framecode GrxS14 _Entity.Entry_ID 19850 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name GrxS14 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; SALTPQLKDTLEKLVNSEKV VLFMKGTRDFPMCGFSNTVV QILKNLNVPFEDVNILENEM LRQGLKEYSNWPTFPQLYIG GEFFGGCDITLEAFKTGELQ EEVEKAMCS ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 109 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state . _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 12196.089 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 yes UNP Q84Y95 . GrxS14 . . . . . . . . . . . . . . 19850 1 2 no PDB 2MMA . "Nmr-based Docking Model Of Grxs14-bola2 Apo-heterodimer From Arabidopsis Thaliana" . . . . . 98.17 107 100.00 100.00 7.69e-71 . . . . 19850 1 3 no PDB 3IPZ . "Crystal Structure Of Arabidopsis Monothiol Glutaredoxin Atgr" . . . . . 100.00 109 100.00 100.00 1.76e-72 . . . . 19850 1 4 no EMBL CAB41094 . "putative protein [Arabidopsis thaliana]" . . . . . 100.00 173 100.00 100.00 2.23e-73 . . . . 19850 1 5 no GB AAK60300 . "AT3g54900/F28P10_120 [Arabidopsis thaliana]" . . . . . 100.00 173 100.00 100.00 2.23e-73 . . . . 19850 1 6 no GB AAL77721 . "AT3g54900/F28P10_120 [Arabidopsis thaliana]" . . . . . 100.00 173 100.00 100.00 2.23e-73 . . . . 19850 1 7 no GB AAO19647 . "CAXIP1 protein [Arabidopsis thaliana]" . . . . . 100.00 173 100.00 100.00 3.38e-73 . . . . 19850 1 8 no GB AEE79309 . "CAX interacting protein 1 [Arabidopsis thaliana]" . . . . . 100.00 173 100.00 100.00 2.23e-73 . . . . 19850 1 9 no GB EFH54264 . "hypothetical protein ARALYDRAFT_906905 [Arabidopsis lyrata subsp. lyrata]" . . . . . 100.00 171 99.08 100.00 1.18e-72 . . . . 19850 1 10 no REF NP_191050 . "CAX interacting protein 1 [Arabidopsis thaliana]" . . . . . 100.00 173 100.00 100.00 2.23e-73 . . . . 19850 1 11 no REF XP_002878005 . "hypothetical protein ARALYDRAFT_906905 [Arabidopsis lyrata subsp. lyrata]" . . . . . 100.00 171 99.08 100.00 1.18e-72 . . . . 19850 1 12 no REF XP_002883576 . "hypothetical protein ARALYDRAFT_899116 [Arabidopsis lyrata subsp. lyrata]" . . . . . 64.22 133 98.57 100.00 2.33e-40 . . . . 19850 1 13 no REF XP_002893837 . "hypothetical protein ARALYDRAFT_336548 [Arabidopsis lyrata subsp. lyrata]" . . . . . 64.22 112 97.14 100.00 9.04e-40 . . . . 19850 1 14 no SP Q84Y95 . "RecName: Full=Monothiol glutaredoxin-S14, chloroplastic; Short=AtGRXcp; Short=AtGrxS14; AltName: Full=CAX-interacting protein 1" . . . . . 100.00 173 100.00 100.00 2.23e-73 . . . . 19850 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 65 SER . 19850 1 2 66 ALA . 19850 1 3 67 LEU . 19850 1 4 68 THR . 19850 1 5 69 PRO . 19850 1 6 70 GLN . 19850 1 7 71 LEU . 19850 1 8 72 LYS . 19850 1 9 73 ASP . 19850 1 10 74 THR . 19850 1 11 75 LEU . 19850 1 12 76 GLU . 19850 1 13 77 LYS . 19850 1 14 78 LEU . 19850 1 15 79 VAL . 19850 1 16 80 ASN . 19850 1 17 81 SER . 19850 1 18 82 GLU . 19850 1 19 83 LYS . 19850 1 20 84 VAL . 19850 1 21 85 VAL . 19850 1 22 86 LEU . 19850 1 23 87 PHE . 19850 1 24 88 MET . 19850 1 25 89 LYS . 19850 1 26 90 GLY . 19850 1 27 91 THR . 19850 1 28 92 ARG . 19850 1 29 93 ASP . 19850 1 30 94 PHE . 19850 1 31 95 PRO . 19850 1 32 96 MET . 19850 1 33 97 CYS . 19850 1 34 98 GLY . 19850 1 35 99 PHE . 19850 1 36 100 SER . 19850 1 37 101 ASN . 19850 1 38 102 THR . 19850 1 39 103 VAL . 19850 1 40 104 VAL . 19850 1 41 105 GLN . 19850 1 42 106 ILE . 19850 1 43 107 LEU . 19850 1 44 108 LYS . 19850 1 45 109 ASN . 19850 1 46 110 LEU . 19850 1 47 111 ASN . 19850 1 48 112 VAL . 19850 1 49 113 PRO . 19850 1 50 114 PHE . 19850 1 51 115 GLU . 19850 1 52 116 ASP . 19850 1 53 117 VAL . 19850 1 54 118 ASN . 19850 1 55 119 ILE . 19850 1 56 120 LEU . 19850 1 57 121 GLU . 19850 1 58 122 ASN . 19850 1 59 123 GLU . 19850 1 60 124 MET . 19850 1 61 125 LEU . 19850 1 62 126 ARG . 19850 1 63 127 GLN . 19850 1 64 128 GLY . 19850 1 65 129 LEU . 19850 1 66 130 LYS . 19850 1 67 131 GLU . 19850 1 68 132 TYR . 19850 1 69 133 SER . 19850 1 70 134 ASN . 19850 1 71 135 TRP . 19850 1 72 136 PRO . 19850 1 73 137 THR . 19850 1 74 138 PHE . 19850 1 75 139 PRO . 19850 1 76 140 GLN . 19850 1 77 141 LEU . 19850 1 78 142 TYR . 19850 1 79 143 ILE . 19850 1 80 144 GLY . 19850 1 81 145 GLY . 19850 1 82 146 GLU . 19850 1 83 147 PHE . 19850 1 84 148 PHE . 19850 1 85 149 GLY . 19850 1 86 150 GLY . 19850 1 87 151 CYS . 19850 1 88 152 ASP . 19850 1 89 153 ILE . 19850 1 90 154 THR . 19850 1 91 155 LEU . 19850 1 92 156 GLU . 19850 1 93 157 ALA . 19850 1 94 158 PHE . 19850 1 95 159 LYS . 19850 1 96 160 THR . 19850 1 97 161 GLY . 19850 1 98 162 GLU . 19850 1 99 163 LEU . 19850 1 100 164 GLN . 19850 1 101 165 GLU . 19850 1 102 166 GLU . 19850 1 103 167 VAL . 19850 1 104 168 GLU . 19850 1 105 169 LYS . 19850 1 106 170 ALA . 19850 1 107 171 MET . 19850 1 108 172 CYS . 19850 1 109 173 SER . 19850 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . SER 1 1 19850 1 . ALA 2 2 19850 1 . LEU 3 3 19850 1 . THR 4 4 19850 1 . PRO 5 5 19850 1 . GLN 6 6 19850 1 . LEU 7 7 19850 1 . LYS 8 8 19850 1 . ASP 9 9 19850 1 . THR 10 10 19850 1 . LEU 11 11 19850 1 . GLU 12 12 19850 1 . LYS 13 13 19850 1 . LEU 14 14 19850 1 . VAL 15 15 19850 1 . ASN 16 16 19850 1 . SER 17 17 19850 1 . GLU 18 18 19850 1 . LYS 19 19 19850 1 . VAL 20 20 19850 1 . VAL 21 21 19850 1 . LEU 22 22 19850 1 . PHE 23 23 19850 1 . MET 24 24 19850 1 . LYS 25 25 19850 1 . GLY 26 26 19850 1 . THR 27 27 19850 1 . ARG 28 28 19850 1 . ASP 29 29 19850 1 . PHE 30 30 19850 1 . PRO 31 31 19850 1 . MET 32 32 19850 1 . CYS 33 33 19850 1 . GLY 34 34 19850 1 . PHE 35 35 19850 1 . SER 36 36 19850 1 . ASN 37 37 19850 1 . THR 38 38 19850 1 . VAL 39 39 19850 1 . VAL 40 40 19850 1 . GLN 41 41 19850 1 . ILE 42 42 19850 1 . LEU 43 43 19850 1 . LYS 44 44 19850 1 . ASN 45 45 19850 1 . LEU 46 46 19850 1 . ASN 47 47 19850 1 . VAL 48 48 19850 1 . PRO 49 49 19850 1 . PHE 50 50 19850 1 . GLU 51 51 19850 1 . ASP 52 52 19850 1 . VAL 53 53 19850 1 . ASN 54 54 19850 1 . ILE 55 55 19850 1 . LEU 56 56 19850 1 . GLU 57 57 19850 1 . ASN 58 58 19850 1 . GLU 59 59 19850 1 . MET 60 60 19850 1 . LEU 61 61 19850 1 . ARG 62 62 19850 1 . GLN 63 63 19850 1 . GLY 64 64 19850 1 . LEU 65 65 19850 1 . LYS 66 66 19850 1 . GLU 67 67 19850 1 . TYR 68 68 19850 1 . SER 69 69 19850 1 . ASN 70 70 19850 1 . TRP 71 71 19850 1 . PRO 72 72 19850 1 . THR 73 73 19850 1 . PHE 74 74 19850 1 . PRO 75 75 19850 1 . GLN 76 76 19850 1 . LEU 77 77 19850 1 . TYR 78 78 19850 1 . ILE 79 79 19850 1 . GLY 80 80 19850 1 . GLY 81 81 19850 1 . GLU 82 82 19850 1 . PHE 83 83 19850 1 . PHE 84 84 19850 1 . GLY 85 85 19850 1 . GLY 86 86 19850 1 . CYS 87 87 19850 1 . ASP 88 88 19850 1 . ILE 89 89 19850 1 . THR 90 90 19850 1 . LEU 91 91 19850 1 . GLU 92 92 19850 1 . ALA 93 93 19850 1 . PHE 94 94 19850 1 . LYS 95 95 19850 1 . THR 96 96 19850 1 . GLY 97 97 19850 1 . GLU 98 98 19850 1 . LEU 99 99 19850 1 . GLN 100 100 19850 1 . GLU 101 101 19850 1 . GLU 102 102 19850 1 . VAL 103 103 19850 1 . GLU 104 104 19850 1 . LYS 105 105 19850 1 . ALA 106 106 19850 1 . MET 107 107 19850 1 . CYS 108 108 19850 1 . SER 109 109 19850 1 stop_ save_ save_BolA2 _Entity.Sf_category entity _Entity.Sf_framecode BolA2 _Entity.Entry_ID 19850 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name BolA2 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID B _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; VTKEQVEASLTSKLKPIHLE VIDISGGCGSSFEVEVVSEQ FEGKRLLERHRMVNAALEEE MKEIHALSIKKAQTPQQWKP ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 80 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state . _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 9042.453 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-01-29 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 yes UNP Q9FIC3 . BolA2 . . . . . . . . . . . . . . 19850 2 2 no BMRB 19849 . BolA2 . . . . . 100.00 93 100.00 100.00 1.94e-49 . . . . 19850 2 3 no PDB 2MM9 . "Solution Structure Of Reduced Bola2 From Arabidopsis Thaliana" . . . . . 100.00 93 100.00 100.00 1.94e-49 . . . . 19850 2 4 no PDB 2MMA . "Nmr-based Docking Model Of Grxs14-bola2 Apo-heterodimer From Arabidopsis Thaliana" . . . . . 100.00 80 100.00 100.00 4.25e-49 . . . . 19850 2 5 no DBJ BAB09404 . "unnamed protein product [Arabidopsis thaliana]" . . . . . 100.00 93 100.00 100.00 1.94e-49 . . . . 19850 2 6 no DBJ BAF00125 . "hypothetical protein [Arabidopsis thaliana]" . . . . . 100.00 93 100.00 100.00 1.94e-49 . . . . 19850 2 7 no EMBL CDX69884 . "BnaA10g22330D [Brassica napus]" . . . . . 100.00 92 98.75 98.75 1.70e-48 . . . . 19850 2 8 no EMBL CDY21608 . "BnaC09g46840D [Brassica napus]" . . . . . 100.00 92 98.75 98.75 1.34e-48 . . . . 19850 2 9 no GB AAM65194 . "unknown [Arabidopsis thaliana]" . . . . . 100.00 93 100.00 100.00 1.94e-49 . . . . 19850 2 10 no GB AAO24583 . "At5g09830 [Arabidopsis thaliana]" . . . . . 100.00 93 100.00 100.00 1.94e-49 . . . . 19850 2 11 no GB AED91453 . "BolA-like family protein [Arabidopsis thaliana]" . . . . . 100.00 93 100.00 100.00 1.94e-49 . . . . 19850 2 12 no GB EFH49685 . "hypothetical protein ARALYDRAFT_487805 [Arabidopsis lyrata subsp. lyrata]" . . . . . 100.00 93 97.50 100.00 7.57e-49 . . . . 19850 2 13 no GB KFK25275 . "hypothetical protein AALP_AA8G090900 [Arabis alpina]" . . . . . 100.00 94 98.75 100.00 2.83e-49 . . . . 19850 2 14 no REF NP_568217 . "protein BolA2 [Arabidopsis thaliana]" . . . . . 100.00 93 100.00 100.00 1.94e-49 . . . . 19850 2 15 no REF XP_002873426 . "hypothetical protein ARALYDRAFT_487805 [Arabidopsis lyrata subsp. lyrata]" . . . . . 100.00 93 97.50 100.00 7.57e-49 . . . . 19850 2 16 no REF XP_009122117 . "PREDICTED: uncharacterized bolA-like protein C8C9.11 [Brassica rapa]" . . . . . 100.00 92 97.50 98.75 4.78e-48 . . . . 19850 2 17 no REF XP_010491626 . "PREDICTED: uncharacterized bolA-like protein C8C9.11 [Camelina sativa]" . . . . . 100.00 92 97.50 100.00 9.55e-49 . . . . 19850 2 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 2 VAL . 19850 2 2 3 THR . 19850 2 3 4 LYS . 19850 2 4 5 GLU . 19850 2 5 6 GLN . 19850 2 6 7 VAL . 19850 2 7 8 GLU . 19850 2 8 9 ALA . 19850 2 9 10 SER . 19850 2 10 11 LEU . 19850 2 11 12 THR . 19850 2 12 13 SER . 19850 2 13 14 LYS . 19850 2 14 15 LEU . 19850 2 15 16 LYS . 19850 2 16 17 PRO . 19850 2 17 18 ILE . 19850 2 18 19 HIS . 19850 2 19 20 LEU . 19850 2 20 21 GLU . 19850 2 21 22 VAL . 19850 2 22 23 ILE . 19850 2 23 24 ASP . 19850 2 24 25 ILE . 19850 2 25 26 SER . 19850 2 26 27 GLY . 19850 2 27 28 GLY . 19850 2 28 29 CYS . 19850 2 29 30 GLY . 19850 2 30 31 SER . 19850 2 31 32 SER . 19850 2 32 33 PHE . 19850 2 33 34 GLU . 19850 2 34 35 VAL . 19850 2 35 36 GLU . 19850 2 36 37 VAL . 19850 2 37 38 VAL . 19850 2 38 39 SER . 19850 2 39 40 GLU . 19850 2 40 41 GLN . 19850 2 41 42 PHE . 19850 2 42 43 GLU . 19850 2 43 44 GLY . 19850 2 44 45 LYS . 19850 2 45 46 ARG . 19850 2 46 47 LEU . 19850 2 47 48 LEU . 19850 2 48 49 GLU . 19850 2 49 50 ARG . 19850 2 50 51 HIS . 19850 2 51 52 ARG . 19850 2 52 53 MET . 19850 2 53 54 VAL . 19850 2 54 55 ASN . 19850 2 55 56 ALA . 19850 2 56 57 ALA . 19850 2 57 58 LEU . 19850 2 58 59 GLU . 19850 2 59 60 GLU . 19850 2 60 61 GLU . 19850 2 61 62 MET . 19850 2 62 63 LYS . 19850 2 63 64 GLU . 19850 2 64 65 ILE . 19850 2 65 66 HIS . 19850 2 66 67 ALA . 19850 2 67 68 LEU . 19850 2 68 69 SER . 19850 2 69 70 ILE . 19850 2 70 71 LYS . 19850 2 71 72 LYS . 19850 2 72 73 ALA . 19850 2 73 74 GLN . 19850 2 74 75 THR . 19850 2 75 76 PRO . 19850 2 76 77 GLN . 19850 2 77 78 GLN . 19850 2 78 79 TRP . 19850 2 79 80 LYS . 19850 2 80 81 PRO . 19850 2 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . VAL 1 1 19850 2 . THR 2 2 19850 2 . LYS 3 3 19850 2 . GLU 4 4 19850 2 . GLN 5 5 19850 2 . VAL 6 6 19850 2 . GLU 7 7 19850 2 . ALA 8 8 19850 2 . SER 9 9 19850 2 . LEU 10 10 19850 2 . THR 11 11 19850 2 . SER 12 12 19850 2 . LYS 13 13 19850 2 . LEU 14 14 19850 2 . LYS 15 15 19850 2 . PRO 16 16 19850 2 . ILE 17 17 19850 2 . HIS 18 18 19850 2 . LEU 19 19 19850 2 . GLU 20 20 19850 2 . VAL 21 21 19850 2 . ILE 22 22 19850 2 . ASP 23 23 19850 2 . ILE 24 24 19850 2 . SER 25 25 19850 2 . GLY 26 26 19850 2 . GLY 27 27 19850 2 . CYS 28 28 19850 2 . GLY 29 29 19850 2 . SER 30 30 19850 2 . SER 31 31 19850 2 . PHE 32 32 19850 2 . GLU 33 33 19850 2 . VAL 34 34 19850 2 . GLU 35 35 19850 2 . VAL 36 36 19850 2 . VAL 37 37 19850 2 . SER 38 38 19850 2 . GLU 39 39 19850 2 . GLN 40 40 19850 2 . PHE 41 41 19850 2 . GLU 42 42 19850 2 . GLY 43 43 19850 2 . LYS 44 44 19850 2 . ARG 45 45 19850 2 . LEU 46 46 19850 2 . LEU 47 47 19850 2 . GLU 48 48 19850 2 . ARG 49 49 19850 2 . HIS 50 50 19850 2 . ARG 51 51 19850 2 . MET 52 52 19850 2 . VAL 53 53 19850 2 . ASN 54 54 19850 2 . ALA 55 55 19850 2 . ALA 56 56 19850 2 . LEU 57 57 19850 2 . GLU 58 58 19850 2 . GLU 59 59 19850 2 . GLU 60 60 19850 2 . MET 61 61 19850 2 . LYS 62 62 19850 2 . GLU 63 63 19850 2 . ILE 64 64 19850 2 . HIS 65 65 19850 2 . ALA 66 66 19850 2 . LEU 67 67 19850 2 . SER 68 68 19850 2 . ILE 69 69 19850 2 . LYS 70 70 19850 2 . LYS 71 71 19850 2 . ALA 72 72 19850 2 . GLN 73 73 19850 2 . THR 74 74 19850 2 . PRO 75 75 19850 2 . GLN 76 76 19850 2 . GLN 77 77 19850 2 . TRP 78 78 19850 2 . LYS 79 79 19850 2 . PRO 80 80 19850 2 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 19850 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $GrxS14 . 3702 organism . 'Arabidopsis thaliana' 'Thale cress' . . Eukaryota Viridiplantae Arabidopsis thaliana . . . . . . . . . . . . . . . . . . . . . 19850 1 2 2 $BolA2 . 3702 organism . 'Arabidopsis thaliana' 'Thale cress' . . Eukaryota Viridiplantae Arabidopsis thaliana . . . . . . . . . . . . . . . . . . . . . 19850 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source _Entity_experimental_src_list.Entry_ID 19850 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $GrxS14 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . pET15b . . . . . . 19850 1 2 2 $BolA2 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . pET3d . . . . . . 19850 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 19850 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 BolA2 '[U-100% 15N]' . . 2 $BolA2 . . 0.12 . . mM . . . . 19850 1 2 GrxS14 'natural abundance' . . 1 $GrxS14 . . . 0.012 0.24 mM . . . . 19850 1 3 'phosphate buffer' 'natural abundance' . . . . . . 50 . . mM . . . . 19850 1 4 azide 'natural abundance' . . . . . . 0.02 . . % . . . . 19850 1 5 H2O 'natural abundance' . . . . . . 90 . . % . . . . 19850 1 6 D2O 'natural abundance' . . . . . . 10 . . % . . . . 19850 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 19850 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 GrxS14 '[U-100% 15N]' . . 1 $GrxS14 . . 0.12 . . mM . . . . 19850 2 2 BolA2 'natural abundance' . . 2 $BolA2 . . . 0.012 0.24 mM . . . . 19850 2 3 'phosphate buffer' 'natural abundance' . . . . . . 50 . . mM . . . . 19850 2 4 azide 'natural abundance' . . . . . . 0.02 . . % . . . . 19850 2 5 H2O 'natural abundance' . . . . . . 90 . . % . . . . 19850 2 6 D2O 'natural abundance' . . . . . . 10 . . % . . . . 19850 2 stop_ save_ save_sample_3 _Sample.Sf_category sample _Sample.Sf_framecode sample_3 _Sample.Entry_ID 19850 _Sample.ID 3 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 GrxS14 '[U-100% 15N]' . . 1 $GrxS14 . . 0.12 . . mM . . . . 19850 3 2 'phosphate buffer' 'natural abundance' . . . . . . 50 . . mM . . . . 19850 3 3 azide 'natural abundance' . . . . . . 0.02 . . % . . . . 19850 3 4 H2O 'natural abundance' . . . . . . 90 . . % . . . . 19850 3 5 D2O 'natural abundance' . . . . . . 10 . . % . . . . 19850 3 stop_ save_ save_sample_4 _Sample.Sf_category sample _Sample.Sf_framecode sample_4 _Sample.Entry_ID 19850 _Sample.ID 4 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 BolA2 '[U-100% 15N]' . . 2 $BolA2 . . 0.12 . . mM . . . . 19850 4 2 'phosphate buffer' 'natural abundance' . . . . . . 50 . . mM . . . . 19850 4 3 azide 'natural abundance' . . . . . . 0.02 . . % . . . . 19850 4 4 H2O 'natural abundance' . . . . . . 90 . . % . . . . 19850 4 5 D2O 'natural abundance' . . . . . . 10 . . % . . . . 19850 4 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 19850 _Sample_condition_list.ID 1 _Sample_condition_list.Details ; 50 mM phosphate buffer pH7 0.02% azide ; loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.05 . M 19850 1 pH 7 . pH 19850 1 pressure 1 . atm 19850 1 temperature 298 . K 19850 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRView _Software.Sf_category software _Software.Sf_framecode NMRView _Software.Entry_ID 19850 _Software.ID 1 _Software.Name NMRView _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, One Moon Scientific' . . 19850 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 19850 1 'peak picking' 19850 1 stop_ save_ save_GRAMM-X_Protein-Protein_Docking_Web_Server _Software.Sf_category software _Software.Sf_framecode GRAMM-X_Protein-Protein_Docking_Web_Server _Software.Entry_ID 19850 _Software.ID 2 _Software.Name GRAMM-X_Protein-Protein_Docking_Web_Server _Software.Version 1.2.0 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Tovchigrechko A' . atovtchi@jcvi.org 19850 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 19850 2 stop_ save_ save_YASARA_Energy_Minimization_Server _Software.Sf_category software _Software.Sf_framecode YASARA_Energy_Minimization_Server _Software.Entry_ID 19850 _Software.ID 3 _Software.Name YASARA_Energy_Minimization_Server _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID KRIEGER . . 19850 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'geometry optimization' 19850 3 refinement 19850 3 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 19850 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 19850 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker DRX . 600 . . . 19850 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 19850 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19850 1 2 '2D 1H-15N HSQC' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19850 1 3 '2D 1H-15N HSQC' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19850 1 4 '2D 1H-15N HSQC' no . . . . . . . . . . 4 $sample_4 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19850 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 19850 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 19850 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . . . . . 19850 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_GRXS14_assigned_chem_shifts _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode GRXS14_assigned_chem_shifts _Assigned_chem_shift_list.Entry_ID 19850 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 3 '2D 1H-15N HSQC' 3 $sample_3 . 19850 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 SER H H 1 7.98 . . . . . . . 65 SER H . 19850 1 2 . 1 1 1 1 SER N N 15 122.17 . . . . . . . 65 SER N . 19850 1 3 . 1 1 2 2 ALA H H 1 8.98 . . . . . . . 66 ALA H . 19850 1 4 . 1 1 2 2 ALA N N 15 120.11 . . . . . . . 66 ALA N . 19850 1 5 . 1 1 3 3 LEU H H 1 7.75 . . . . . . A 67 LEU H . 19850 1 6 . 1 1 3 3 LEU N N 15 117.68 . . . . . . A 67 LEU N . 19850 1 7 . 1 1 4 4 THR H H 1 7.7 . . . . . . A 68 THR H . 19850 1 8 . 1 1 4 4 THR N N 15 117.91 . . . . . . A 68 THR N . 19850 1 9 . 1 1 7 7 LEU H H 1 7.93 . . . . . . A 71 LEU H . 19850 1 10 . 1 1 7 7 LEU N N 15 121.29 . . . . . . A 71 LEU N . 19850 1 11 . 1 1 8 8 LYS H H 1 8.67 . . . . . . A 72 LYS H . 19850 1 12 . 1 1 8 8 LYS N N 15 120.01 . . . . . . A 72 LYS N . 19850 1 13 . 1 1 9 9 ASP H H 1 7.81 . . . . . . A 73 ASP H . 19850 1 14 . 1 1 9 9 ASP N N 15 115.45 . . . . . . A 73 ASP N . 19850 1 15 . 1 1 10 10 THR H H 1 7.85 . . . . . . A 74 THR H . 19850 1 16 . 1 1 10 10 THR N N 15 120.55 . . . . . . A 74 THR N . 19850 1 17 . 1 1 11 11 LEU H H 1 8.39 . . . . . . A 75 LEU H . 19850 1 18 . 1 1 11 11 LEU N N 15 121.93 . . . . . . A 75 LEU N . 19850 1 19 . 1 1 12 12 GLU H H 1 8.42 . . . . . . A 76 GLU H . 19850 1 20 . 1 1 12 12 GLU N N 15 119.26 . . . . . . A 76 GLU N . 19850 1 21 . 1 1 13 13 LYS H H 1 8.55 . . . . . . A 77 LYS H . 19850 1 22 . 1 1 13 13 LYS N N 15 118.64 . . . . . . A 77 LYS N . 19850 1 23 . 1 1 14 14 LEU H H 1 8.05 . . . . . . A 78 LEU H . 19850 1 24 . 1 1 14 14 LEU N N 15 121.4 . . . . . . A 78 LEU N . 19850 1 25 . 1 1 15 15 VAL H H 1 8.63 . . . . . . A 79 VAL H . 19850 1 26 . 1 1 15 15 VAL N N 15 113.18 . . . . . . A 79 VAL N . 19850 1 27 . 1 1 16 16 ASN H H 1 7.13 . . . . . . A 80 ASN H . 19850 1 28 . 1 1 16 16 ASN N N 15 114.49 . . . . . . A 80 ASN N . 19850 1 29 . 1 1 17 17 SER H H 1 7.58 . . . . . . A 81 SER H . 19850 1 30 . 1 1 17 17 SER N N 15 116.67 . . . . . . A 81 SER N . 19850 1 31 . 1 1 18 18 GLU H H 1 7.06 . . . . . . A 82 GLU H . 19850 1 32 . 1 1 18 18 GLU N N 15 118.44 . . . . . . A 82 GLU N . 19850 1 33 . 1 1 19 19 LYS H H 1 8.51 . . . . . . A 83 LYS H . 19850 1 34 . 1 1 19 19 LYS N N 15 122.21 . . . . . . A 83 LYS N . 19850 1 35 . 1 1 20 20 VAL H H 1 8.55 . . . . . . A 84 VAL H . 19850 1 36 . 1 1 20 20 VAL N N 15 118.64 . . . . . . A 84 VAL N . 19850 1 37 . 1 1 21 21 VAL H H 1 8.87 . . . . . . A 85 VAL H . 19850 1 38 . 1 1 21 21 VAL N N 15 126.95 . . . . . . A 85 VAL N . 19850 1 39 . 1 1 22 22 LEU H H 1 9.05 . . . . . . A 86 LEU H . 19850 1 40 . 1 1 22 22 LEU N N 15 128.27 . . . . . . A 86 LEU N . 19850 1 41 . 1 1 23 23 PHE H H 1 9.2 . . . . . . A 87 PHE H . 19850 1 42 . 1 1 23 23 PHE N N 15 126.34 . . . . . . A 87 PHE N . 19850 1 43 . 1 1 24 24 MET H H 1 9.53 . . . . . . A 88 MET H . 19850 1 44 . 1 1 24 24 MET N N 15 120.92 . . . . . . A 88 MET N . 19850 1 45 . 1 1 25 25 LYS H H 1 8.26 . . . . . . A 89 LYS H . 19850 1 46 . 1 1 25 25 LYS N N 15 118.35 . . . . . . A 89 LYS N . 19850 1 47 . 1 1 26 26 GLY H H 1 7.95 . . . . . . A 90 GLY H . 19850 1 48 . 1 1 26 26 GLY N N 15 116.4 . . . . . . A 90 GLY N . 19850 1 49 . 1 1 27 27 THR H H 1 7.06 . . . . . . A 91 THR H . 19850 1 50 . 1 1 27 27 THR N N 15 107.57 . . . . . . A 91 THR N . 19850 1 51 . 1 1 28 28 ARG H H 1 8.6 . . . . . . A 92 ARG H . 19850 1 52 . 1 1 28 28 ARG N N 15 117.1 . . . . . . A 92 ARG N . 19850 1 53 . 1 1 29 29 ASP H H 1 7.64 . . . . . . A 93 ASP H . 19850 1 54 . 1 1 29 29 ASP N N 15 115.19 . . . . . . A 93 ASP N . 19850 1 55 . 1 1 30 30 PHE H H 1 7.41 . . . . . . A 94 PHE H . 19850 1 56 . 1 1 30 30 PHE N N 15 119.05 . . . . . . A 94 PHE N . 19850 1 57 . 1 1 32 32 MET H H 1 8.57 . . . . . . A 96 MET H . 19850 1 58 . 1 1 32 32 MET N N 15 120.11 . . . . . . A 96 MET N . 19850 1 59 . 1 1 33 33 CYS H H 1 7.32 . . . . . . A 97 CYS H . 19850 1 60 . 1 1 33 33 CYS N N 15 117.9 . . . . . . A 97 CYS N . 19850 1 61 . 1 1 35 35 PHE H H 1 6.79 . . . . . . A 99 PHE H . 19850 1 62 . 1 1 35 35 PHE N N 15 116.4 . . . . . . A 99 PHE N . 19850 1 63 . 1 1 36 36 SER H H 1 8.98 . . . . . . A 100 SER H . 19850 1 64 . 1 1 36 36 SER N N 15 120.11 . . . . . . A 100 SER N . 19850 1 65 . 1 1 37 37 ASN H H 1 8.55 . . . . . . A 101 ASN H . 19850 1 66 . 1 1 37 37 ASN N N 15 118.64 . . . . . . A 101 ASN N . 19850 1 67 . 1 1 38 38 THR H H 1 8.24 . . . . . . A 102 THR H . 19850 1 68 . 1 1 38 38 THR N N 15 115.54 . . . . . . A 102 THR N . 19850 1 69 . 1 1 39 39 VAL H H 1 7.32 . . . . . . A 103 VAL H . 19850 1 70 . 1 1 39 39 VAL N N 15 117.9 . . . . . . A 103 VAL N . 19850 1 71 . 1 1 40 40 VAL H H 1 8.03 . . . . . . A 104 VAL H . 19850 1 72 . 1 1 40 40 VAL N N 15 119.62 . . . . . . A 104 VAL N . 19850 1 73 . 1 1 41 41 GLN H H 1 8.09 . . . . . . A 105 GLN H . 19850 1 74 . 1 1 41 41 GLN N N 15 116.45 . . . . . . A 105 GLN N . 19850 1 75 . 1 1 42 42 ILE H H 1 7.67 . . . . . . A 106 ILE H . 19850 1 76 . 1 1 42 42 ILE N N 15 121.09 . . . . . . A 106 ILE N . 19850 1 77 . 1 1 43 43 LEU H H 1 7.53 . . . . . . A 107 LEU H . 19850 1 78 . 1 1 43 43 LEU N N 15 117.76 . . . . . . A 107 LEU N . 19850 1 79 . 1 1 44 44 LYS H H 1 8.55 . . . . . . A 108 LYS H . 19850 1 80 . 1 1 44 44 LYS N N 15 118.64 . . . . . . A 108 LYS N . 19850 1 81 . 1 1 45 45 ASN H H 1 8.01 . . . . . . A 109 ASN H . 19850 1 82 . 1 1 45 45 ASN N N 15 119.6 . . . . . . A 109 ASN N . 19850 1 83 . 1 1 46 46 LEU H H 1 7.58 . . . . . . A 110 LEU H . 19850 1 84 . 1 1 46 46 LEU N N 15 118.98 . . . . . . A 110 LEU N . 19850 1 85 . 1 1 47 47 ASN H H 1 7.88 . . . . . . A 111 ASN H . 19850 1 86 . 1 1 47 47 ASN N N 15 115.39 . . . . . . A 111 ASN N . 19850 1 87 . 1 1 48 48 VAL H H 1 7.34 . . . . . . A 112 VAL H . 19850 1 88 . 1 1 48 48 VAL N N 15 114.46 . . . . . . A 112 VAL N . 19850 1 89 . 1 1 50 50 PHE H H 1 7.99 . . . . . . A 114 PHE H . 19850 1 90 . 1 1 50 50 PHE N N 15 115.98 . . . . . . A 114 PHE N . 19850 1 91 . 1 1 51 51 GLU H H 1 7.75 . . . . . . A 115 GLU H . 19850 1 92 . 1 1 51 51 GLU N N 15 122.8 . . . . . . A 115 GLU N . 19850 1 93 . 1 1 52 52 ASP H H 1 9.02 . . . . . . A 116 ASP H . 19850 1 94 . 1 1 52 52 ASP N N 15 123.17 . . . . . . A 116 ASP N . 19850 1 95 . 1 1 53 53 VAL H H 1 8.74 . . . . . . A 117 VAL H . 19850 1 96 . 1 1 53 53 VAL N N 15 123.71 . . . . . . A 117 VAL N . 19850 1 97 . 1 1 54 54 ASN H H 1 8.56 . . . . . . A 118 ASN H . 19850 1 98 . 1 1 54 54 ASN N N 15 125.27 . . . . . . A 118 ASN N . 19850 1 99 . 1 1 55 55 ILE H H 1 8.98 . . . . . . A 119 ILE H . 19850 1 100 . 1 1 55 55 ILE N N 15 120.11 . . . . . . A 119 ILE N . 19850 1 101 . 1 1 56 56 LEU H H 1 8 . . . . . . A 120 LEU H . 19850 1 102 . 1 1 56 56 LEU N N 15 118.22 . . . . . . A 120 LEU N . 19850 1 103 . 1 1 57 57 GLU H H 1 7.19 . . . . . . A 121 GLU H . 19850 1 104 . 1 1 57 57 GLU N N 15 113.58 . . . . . . A 121 GLU N . 19850 1 105 . 1 1 58 58 ASN H H 1 7.74 . . . . . . A 122 ASN H . 19850 1 106 . 1 1 58 58 ASN N N 15 113.29 . . . . . . A 122 ASN N . 19850 1 107 . 1 1 59 59 GLU H H 1 8.14 . . . . . . A 123 GLU H . 19850 1 108 . 1 1 59 59 GLU N N 15 114.27 . . . . . . A 123 GLU N . 19850 1 109 . 1 1 60 60 MET H H 1 8.18 . . . . . . A 124 MET H . 19850 1 110 . 1 1 60 60 MET N N 15 119.97 . . . . . . A 124 MET N . 19850 1 111 . 1 1 61 61 LEU H H 1 7.5 . . . . . . A 125 LEU H . 19850 1 112 . 1 1 61 61 LEU N N 15 119.63 . . . . . . A 125 LEU N . 19850 1 113 . 1 1 62 62 ARG H H 1 7.88 . . . . . . A 126 ARG H . 19850 1 114 . 1 1 62 62 ARG N N 15 118 . . . . . . A 126 ARG N . 19850 1 115 . 1 1 63 63 GLN H H 1 7.69 . . . . . . A 127 GLN H . 19850 1 116 . 1 1 63 63 GLN N N 15 112.31 . . . . . . A 127 GLN N . 19850 1 117 . 1 1 64 64 GLY H H 1 8.38 . . . . . . A 128 GLY H . 19850 1 118 . 1 1 64 64 GLY N N 15 107.1 . . . . . . A 128 GLY N . 19850 1 119 . 1 1 65 65 LEU H H 1 8.66 . . . . . . A 129 LEU H . 19850 1 120 . 1 1 65 65 LEU N N 15 122.44 . . . . . . A 129 LEU N . 19850 1 121 . 1 1 66 66 LYS H H 1 7.3 . . . . . . A 130 LYS H . 19850 1 122 . 1 1 66 66 LYS N N 15 118.25 . . . . . . A 130 LYS N . 19850 1 123 . 1 1 67 67 GLU H H 1 6.93 . . . . . . A 131 GLU H . 19850 1 124 . 1 1 67 67 GLU N N 15 116.63 . . . . . . A 131 GLU N . 19850 1 125 . 1 1 68 68 TYR H H 1 8.91 . . . . . . A 132 TYR H . 19850 1 126 . 1 1 68 68 TYR N N 15 121.85 . . . . . . A 132 TYR N . 19850 1 127 . 1 1 69 69 SER H H 1 8.57 . . . . . . A 133 SER H . 19850 1 128 . 1 1 69 69 SER N N 15 110.99 . . . . . . A 133 SER N . 19850 1 129 . 1 1 70 70 ASN H H 1 6.65 . . . . . . A 134 ASN H . 19850 1 130 . 1 1 70 70 ASN N N 15 111.58 . . . . . . A 134 ASN N . 19850 1 131 . 1 1 71 71 TRP H H 1 9.65 . . . . . . A 135 TRP H . 19850 1 132 . 1 1 71 71 TRP N N 15 127.97 . . . . . . A 135 TRP N . 19850 1 133 . 1 1 73 73 THR H H 1 6.17 . . . . . . A 137 THR H . 19850 1 134 . 1 1 73 73 THR N N 15 106.55 . . . . . . A 137 THR N . 19850 1 135 . 1 1 76 76 GLN H H 1 9.3 . . . . . . A 140 GLN H . 19850 1 136 . 1 1 76 76 GLN N N 15 117.53 . . . . . . A 140 GLN N . 19850 1 137 . 1 1 77 77 LEU H H 1 8.42 . . . . . . A 141 LEU H . 19850 1 138 . 1 1 77 77 LEU N N 15 126.29 . . . . . . A 141 LEU N . 19850 1 139 . 1 1 78 78 TYR H H 1 9.79 . . . . . . A 142 TYR H . 19850 1 140 . 1 1 78 78 TYR N N 15 130.14 . . . . . . A 142 TYR N . 19850 1 141 . 1 1 79 79 ILE H H 1 8.55 . . . . . . A 143 ILE H . 19850 1 142 . 1 1 79 79 ILE N N 15 118.64 . . . . . . A 143 ILE N . 19850 1 143 . 1 1 80 80 GLY H H 1 10.17 . . . . . . A 144 GLY H . 19850 1 144 . 1 1 80 80 GLY N N 15 118.37 . . . . . . A 144 GLY N . 19850 1 145 . 1 1 81 81 GLY H H 1 9.54 . . . . . . A 145 GLY H . 19850 1 146 . 1 1 81 81 GLY N N 15 106.42 . . . . . . A 145 GLY N . 19850 1 147 . 1 1 82 82 GLU H H 1 7.89 . . . . . . A 146 GLU H . 19850 1 148 . 1 1 82 82 GLU N N 15 118.35 . . . . . . A 146 GLU N . 19850 1 149 . 1 1 83 83 PHE H H 1 9.04 . . . . . . A 147 PHE H . 19850 1 150 . 1 1 83 83 PHE N N 15 126.28 . . . . . . A 147 PHE N . 19850 1 151 . 1 1 84 84 PHE H H 1 9.02 . . . . . . A 148 PHE H . 19850 1 152 . 1 1 84 84 PHE N N 15 131.85 . . . . . . A 148 PHE N . 19850 1 153 . 1 1 85 85 GLY H H 1 8.5 . . . . . . A 149 GLY H . 19850 1 154 . 1 1 85 85 GLY N N 15 110.7 . . . . . . A 149 GLY N . 19850 1 155 . 1 1 86 86 GLY H H 1 8.4 . . . . . . A 150 GLY H . 19850 1 156 . 1 1 86 86 GLY N N 15 110.25 . . . . . . A 150 GLY N . 19850 1 157 . 1 1 87 87 CYS H H 1 8.29 . . . . . . A 151 CYS H . 19850 1 158 . 1 1 87 87 CYS N N 15 110.39 . . . . . . A 151 CYS N . 19850 1 159 . 1 1 88 88 ASP H H 1 7.78 . . . . . . A 152 ASP H . 19850 1 160 . 1 1 88 88 ASP N N 15 116.73 . . . . . . A 152 ASP N . 19850 1 161 . 1 1 89 89 ILE H H 1 8.34 . . . . . . A 153 ILE H . 19850 1 162 . 1 1 89 89 ILE N N 15 119.81 . . . . . . A 153 ILE N . 19850 1 163 . 1 1 90 90 THR H H 1 7.68 . . . . . . A 154 THR H . 19850 1 164 . 1 1 90 90 THR N N 15 118.83 . . . . . . A 154 THR N . 19850 1 165 . 1 1 91 91 LEU H H 1 8.52 . . . . . . A 155 LEU H . 19850 1 166 . 1 1 91 91 LEU N N 15 121.77 . . . . . . A 155 LEU N . 19850 1 167 . 1 1 92 92 GLU H H 1 7.68 . . . . . . A 156 GLU H . 19850 1 168 . 1 1 92 92 GLU N N 15 118.83 . . . . . . A 156 GLU N . 19850 1 169 . 1 1 93 93 ALA H H 1 8.38 . . . . . . A 157 ALA H . 19850 1 170 . 1 1 93 93 ALA N N 15 122.34 . . . . . . A 157 ALA N . 19850 1 171 . 1 1 94 94 PHE H H 1 8.51 . . . . . . A 158 PHE H . 19850 1 172 . 1 1 94 94 PHE N N 15 122.21 . . . . . . A 158 PHE N . 19850 1 173 . 1 1 95 95 LYS H H 1 7.69 . . . . . . A 159 LYS H . 19850 1 174 . 1 1 95 95 LYS N N 15 120.09 . . . . . . A 159 LYS N . 19850 1 175 . 1 1 96 96 THR H H 1 8.09 . . . . . . A 160 THR H . 19850 1 176 . 1 1 96 96 THR N N 15 106.98 . . . . . . A 160 THR N . 19850 1 177 . 1 1 97 97 GLY H H 1 7.33 . . . . . . A 161 GLY H . 19850 1 178 . 1 1 97 97 GLY N N 15 109.4 . . . . . . A 161 GLY N . 19850 1 179 . 1 1 98 98 GLU H H 1 8.19 . . . . . . A 162 GLU H . 19850 1 180 . 1 1 98 98 GLU N N 15 123.47 . . . . . . A 162 GLU N . 19850 1 181 . 1 1 99 99 LEU H H 1 8.01 . . . . . . A 163 LEU H . 19850 1 182 . 1 1 99 99 LEU N N 15 120.2 . . . . . . A 163 LEU N . 19850 1 183 . 1 1 100 100 GLN H H 1 9.56 . . . . . . A 164 GLN H . 19850 1 184 . 1 1 100 100 GLN N N 15 119.21 . . . . . . A 164 GLN N . 19850 1 185 . 1 1 101 101 GLU H H 1 7.35 . . . . . . A 165 GLU H . 19850 1 186 . 1 1 101 101 GLU N N 15 116.92 . . . . . . A 165 GLU N . 19850 1 187 . 1 1 102 102 GLU H H 1 7.95 . . . . . . A 166 GLU H . 19850 1 188 . 1 1 102 102 GLU N N 15 119.99 . . . . . . A 166 GLU N . 19850 1 189 . 1 1 103 103 VAL H H 1 8.51 . . . . . . A 167 VAL H . 19850 1 190 . 1 1 103 103 VAL N N 15 118.92 . . . . . . A 167 VAL N . 19850 1 191 . 1 1 104 104 GLU H H 1 7.6 . . . . . . A 168 GLU H . 19850 1 192 . 1 1 104 104 GLU N N 15 118.37 . . . . . . A 168 GLU N . 19850 1 193 . 1 1 105 105 LYS H H 1 7.77 . . . . . . A 169 LYS H . 19850 1 194 . 1 1 105 105 LYS N N 15 118.65 . . . . . . A 169 LYS N . 19850 1 195 . 1 1 106 106 ALA H H 1 7.07 . . . . . . A 170 ALA H . 19850 1 196 . 1 1 106 106 ALA N N 15 121.09 . . . . . . A 170 ALA N . 19850 1 197 . 1 1 107 107 MET H H 1 8.14 . . . . . . A 171 MET H . 19850 1 198 . 1 1 107 107 MET N N 15 114.27 . . . . . . A 171 MET N . 19850 1 199 . 1 1 108 108 CYS H H 1 7.78 . . . . . . A 172 CYS H . 19850 1 200 . 1 1 108 108 CYS N N 15 116.73 . . . . . . A 172 CYS N . 19850 1 201 . 1 1 109 109 SER H H 1 7.58 . . . . . . A 173 SER H . 19850 1 202 . 1 1 109 109 SER N N 15 122.9 . . . . . . A 173 SER N . 19850 1 stop_ save_ save_GRXS14-BOLA2 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode GRXS14-BOLA2 _Assigned_chem_shift_list.Entry_ID 19850 _Assigned_chem_shift_list.ID 2 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 2 '2D 1H-15N HSQC' 2 $sample_2 . 19850 2 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 SER H H 1 7.98 . . . . . . . 65 SER H . 19850 2 2 . 1 1 1 1 SER N N 15 122.26 . . . . . . . 65 SER N . 19850 2 3 . 1 1 2 2 ALA H H 1 8.98 . . . . . . . 66 ALA H . 19850 2 4 . 1 1 2 2 ALA N N 15 120.13 . . . . . . . 66 ALA N . 19850 2 5 . 1 1 3 3 LEU H H 1 7.72 . . . . . . A 67 LEU H . 19850 2 6 . 1 1 3 3 LEU N N 15 117.71 . . . . . . A 67 LEU N . 19850 2 7 . 1 1 4 4 THR H H 1 7.72 . . . . . . A 68 THR H . 19850 2 8 . 1 1 4 4 THR N N 15 117.71 . . . . . . A 68 THR N . 19850 2 9 . 1 1 7 7 LEU H H 1 7.95 . . . . . . A 71 LEU H . 19850 2 10 . 1 1 7 7 LEU N N 15 121.36 . . . . . . A 71 LEU N . 19850 2 11 . 1 1 8 8 LYS H H 1 8.65 . . . . . . A 72 LYS H . 19850 2 12 . 1 1 8 8 LYS N N 15 119.99 . . . . . . A 72 LYS N . 19850 2 13 . 1 1 9 9 ASP H H 1 7.82 . . . . . . A 73 ASP H . 19850 2 14 . 1 1 9 9 ASP N N 15 115.48 . . . . . . A 73 ASP N . 19850 2 15 . 1 1 10 10 THR H H 1 7.88 . . . . . . A 74 THR H . 19850 2 16 . 1 1 10 10 THR N N 15 120.7 . . . . . . A 74 THR N . 19850 2 17 . 1 1 11 11 LEU H H 1 8.4 . . . . . . A 75 LEU H . 19850 2 18 . 1 1 11 11 LEU N N 15 121.9 . . . . . . A 75 LEU N . 19850 2 19 . 1 1 12 12 GLU H H 1 8.4 . . . . . . A 76 GLU H . 19850 2 20 . 1 1 12 12 GLU N N 15 119.29 . . . . . . A 76 GLU N . 19850 2 21 . 1 1 13 13 LYS H H 1 8.54 . . . . . . A 77 LYS H . 19850 2 22 . 1 1 13 13 LYS N N 15 118.74 . . . . . . A 77 LYS N . 19850 2 23 . 1 1 14 14 LEU H H 1 8.05 . . . . . . A 78 LEU H . 19850 2 24 . 1 1 14 14 LEU N N 15 121.26 . . . . . . A 78 LEU N . 19850 2 25 . 1 1 15 15 VAL H H 1 8.62 . . . . . . A 79 VAL H . 19850 2 26 . 1 1 15 15 VAL N N 15 112.75 . . . . . . A 79 VAL N . 19850 2 27 . 1 1 16 16 ASN H H 1 7.1 . . . . . . A 80 ASN H . 19850 2 28 . 1 1 16 16 ASN N N 15 114.5 . . . . . . A 80 ASN N . 19850 2 29 . 1 1 17 17 SER H H 1 7.59 . . . . . . A 81 SER H . 19850 2 30 . 1 1 17 17 SER N N 15 116.6 . . . . . . A 81 SER N . 19850 2 31 . 1 1 18 18 GLU H H 1 7.04 . . . . . . A 82 GLU H . 19850 2 32 . 1 1 18 18 GLU N N 15 118.56 . . . . . . A 82 GLU N . 19850 2 33 . 1 1 19 19 LYS H H 1 8.45 . . . . . . A 83 LYS H . 19850 2 34 . 1 1 19 19 LYS N N 15 121.93 . . . . . . A 83 LYS N . 19850 2 35 . 1 1 20 20 VAL H H 1 8.54 . . . . . . A 84 VAL H . 19850 2 36 . 1 1 20 20 VAL N N 15 118.74 . . . . . . A 84 VAL N . 19850 2 37 . 1 1 21 21 VAL H H 1 8.82 . . . . . . A 85 VAL H . 19850 2 38 . 1 1 21 21 VAL N N 15 127.01 . . . . . . A 85 VAL N . 19850 2 39 . 1 1 22 22 LEU H H 1 9.05 . . . . . . A 86 LEU H . 19850 2 40 . 1 1 22 22 LEU N N 15 128.39 . . . . . . A 86 LEU N . 19850 2 41 . 1 1 23 23 PHE H H 1 9.16 . . . . . . A 87 PHE H . 19850 2 42 . 1 1 23 23 PHE N N 15 126.39 . . . . . . A 87 PHE N . 19850 2 43 . 1 1 24 24 MET H H 1 9.51 . . . . . . A 88 MET H . 19850 2 44 . 1 1 24 24 MET N N 15 120.98 . . . . . . A 88 MET N . 19850 2 45 . 1 1 25 25 LYS H H 1 8.26 . . . . . . A 89 LYS H . 19850 2 46 . 1 1 25 25 LYS N N 15 118.35 . . . . . . A 89 LYS N . 19850 2 47 . 1 1 26 26 GLY H H 1 7.94 . . . . . . A 90 GLY H . 19850 2 48 . 1 1 26 26 GLY N N 15 116.39 . . . . . . A 90 GLY N . 19850 2 49 . 1 1 27 27 THR H H 1 7.07 . . . . . . A 91 THR H . 19850 2 50 . 1 1 27 27 THR N N 15 107.54 . . . . . . A 91 THR N . 19850 2 51 . 1 1 28 28 ARG H H 1 8.61 . . . . . . A 92 ARG H . 19850 2 52 . 1 1 28 28 ARG N N 15 117.18 . . . . . . A 92 ARG N . 19850 2 53 . 1 1 29 29 ASP H H 1 7.63 . . . . . . A 93 ASP H . 19850 2 54 . 1 1 29 29 ASP N N 15 115.16 . . . . . . A 93 ASP N . 19850 2 55 . 1 1 30 30 PHE H H 1 7.41 . . . . . . A 94 PHE H . 19850 2 56 . 1 1 30 30 PHE N N 15 118.94 . . . . . . A 94 PHE N . 19850 2 57 . 1 1 32 32 MET H H 1 8.57 . . . . . . A 96 MET H . 19850 2 58 . 1 1 32 32 MET N N 15 120.11 . . . . . . A 96 MET N . 19850 2 59 . 1 1 33 33 CYS H H 1 7.31 . . . . . . A 97 CYS H . 19850 2 60 . 1 1 33 33 CYS N N 15 117.77 . . . . . . A 97 CYS N . 19850 2 61 . 1 1 35 35 PHE H H 1 6.78 . . . . . . A 99 PHE H . 19850 2 62 . 1 1 35 35 PHE N N 15 116.36 . . . . . . A 99 PHE N . 19850 2 63 . 1 1 36 36 SER H H 1 8.98 . . . . . . A 100 SER H . 19850 2 64 . 1 1 36 36 SER N N 15 120.13 . . . . . . A 100 SER N . 19850 2 65 . 1 1 37 37 ASN H H 1 8.54 . . . . . . A 101 ASN H . 19850 2 66 . 1 1 37 37 ASN N N 15 118.74 . . . . . . A 101 ASN N . 19850 2 67 . 1 1 38 38 THR H H 1 8.24 . . . . . . A 102 THR H . 19850 2 68 . 1 1 38 38 THR N N 15 115.69 . . . . . . A 102 THR N . 19850 2 69 . 1 1 39 39 VAL H H 1 7.31 . . . . . . A 103 VAL H . 19850 2 70 . 1 1 39 39 VAL N N 15 117.77 . . . . . . A 103 VAL N . 19850 2 71 . 1 1 40 40 VAL H H 1 8.04 . . . . . . A 104 VAL H . 19850 2 72 . 1 1 40 40 VAL N N 15 119.67 . . . . . . A 104 VAL N . 19850 2 73 . 1 1 41 41 GLN H H 1 8.13 . . . . . . A 105 GLN H . 19850 2 74 . 1 1 41 41 GLN N N 15 116.23 . . . . . . A 105 GLN N . 19850 2 75 . 1 1 42 42 ILE H H 1 7.66 . . . . . . A 106 ILE H . 19850 2 76 . 1 1 42 42 ILE N N 15 121.05 . . . . . . A 106 ILE N . 19850 2 77 . 1 1 43 43 LEU H H 1 7.53 . . . . . . A 107 LEU H . 19850 2 78 . 1 1 43 43 LEU N N 15 117.76 . . . . . . A 107 LEU N . 19850 2 79 . 1 1 44 44 LYS H H 1 8.54 . . . . . . A 108 LYS H . 19850 2 80 . 1 1 44 44 LYS N N 15 118.74 . . . . . . A 108 LYS N . 19850 2 81 . 1 1 45 45 ASN H H 1 8 . . . . . . A 109 ASN H . 19850 2 82 . 1 1 45 45 ASN N N 15 119.54 . . . . . . A 109 ASN N . 19850 2 83 . 1 1 46 46 LEU H H 1 7.62 . . . . . . A 110 LEU H . 19850 2 84 . 1 1 46 46 LEU N N 15 118.74 . . . . . . A 110 LEU N . 19850 2 85 . 1 1 47 47 ASN H H 1 7.89 . . . . . . A 111 ASN H . 19850 2 86 . 1 1 47 47 ASN N N 15 115.55 . . . . . . A 111 ASN N . 19850 2 87 . 1 1 48 48 VAL H H 1 7.36 . . . . . . A 112 VAL H . 19850 2 88 . 1 1 48 48 VAL N N 15 114.89 . . . . . . A 112 VAL N . 19850 2 89 . 1 1 50 50 PHE H H 1 7.97 . . . . . . A 114 PHE H . 19850 2 90 . 1 1 50 50 PHE N N 15 115.77 . . . . . . A 114 PHE N . 19850 2 91 . 1 1 51 51 GLU H H 1 7.77 . . . . . . A 115 GLU H . 19850 2 92 . 1 1 51 51 GLU N N 15 122.81 . . . . . . A 115 GLU N . 19850 2 93 . 1 1 52 52 ASP H H 1 9.05 . . . . . . A 116 ASP H . 19850 2 94 . 1 1 52 52 ASP N N 15 123.23 . . . . . . A 116 ASP N . 19850 2 95 . 1 1 53 53 VAL H H 1 8.75 . . . . . . A 117 VAL H . 19850 2 96 . 1 1 53 53 VAL N N 15 123.76 . . . . . . A 117 VAL N . 19850 2 97 . 1 1 54 54 ASN H H 1 8.58 . . . . . . A 118 ASN H . 19850 2 98 . 1 1 54 54 ASN N N 15 125.28 . . . . . . A 118 ASN N . 19850 2 99 . 1 1 55 55 ILE H H 1 8.98 . . . . . . A 119 ILE H . 19850 2 100 . 1 1 55 55 ILE N N 15 120.13 . . . . . . A 119 ILE N . 19850 2 101 . 1 1 56 56 LEU H H 1 8.02 . . . . . . A 120 LEU H . 19850 2 102 . 1 1 56 56 LEU N N 15 118.29 . . . . . . A 120 LEU N . 19850 2 103 . 1 1 57 57 GLU H H 1 7.18 . . . . . . A 121 GLU H . 19850 2 104 . 1 1 57 57 GLU N N 15 113.56 . . . . . . A 121 GLU N . 19850 2 105 . 1 1 58 58 ASN H H 1 7.75 . . . . . . A 122 ASN H . 19850 2 106 . 1 1 58 58 ASN N N 15 113.33 . . . . . . A 122 ASN N . 19850 2 107 . 1 1 59 59 GLU H H 1 8.17 . . . . . . A 123 GLU H . 19850 2 108 . 1 1 59 59 GLU N N 15 114.27 . . . . . . A 123 GLU N . 19850 2 109 . 1 1 60 60 MET H H 1 8.2 . . . . . . A 124 MET H . 19850 2 110 . 1 1 60 60 MET N N 15 119.96 . . . . . . A 124 MET N . 19850 2 111 . 1 1 61 61 LEU H H 1 7.51 . . . . . . A 125 LEU H . 19850 2 112 . 1 1 61 61 LEU N N 15 119.48 . . . . . . A 125 LEU N . 19850 2 113 . 1 1 62 62 ARG H H 1 7.88 . . . . . . A 126 ARG H . 19850 2 114 . 1 1 62 62 ARG N N 15 118.06 . . . . . . A 126 ARG N . 19850 2 115 . 1 1 63 63 GLN H H 1 7.69 . . . . . . A 127 GLN H . 19850 2 116 . 1 1 63 63 GLN N N 15 112.27 . . . . . . A 127 GLN N . 19850 2 117 . 1 1 64 64 GLY H H 1 8.4 . . . . . . A 128 GLY H . 19850 2 118 . 1 1 64 64 GLY N N 15 107.09 . . . . . . A 128 GLY N . 19850 2 119 . 1 1 65 65 LEU H H 1 8.67 . . . . . . A 129 LEU H . 19850 2 120 . 1 1 65 65 LEU N N 15 122.52 . . . . . . A 129 LEU N . 19850 2 121 . 1 1 66 66 LYS H H 1 7.31 . . . . . . A 130 LYS H . 19850 2 122 . 1 1 66 66 LYS N N 15 117.77 . . . . . . A 130 LYS N . 19850 2 123 . 1 1 67 67 GLU H H 1 6.88 . . . . . . A 131 GLU H . 19850 2 124 . 1 1 67 67 GLU N N 15 116.49 . . . . . . A 131 GLU N . 19850 2 125 . 1 1 68 68 TYR H H 1 9.05 . . . . . . A 132 TYR H . 19850 2 126 . 1 1 68 68 TYR N N 15 122.37 . . . . . . A 132 TYR N . 19850 2 127 . 1 1 69 69 SER H H 1 8.63 . . . . . . A 133 SER H . 19850 2 128 . 1 1 69 69 SER N N 15 111.19 . . . . . . A 133 SER N . 19850 2 129 . 1 1 70 70 ASN H H 1 6.66 . . . . . . A 134 ASN H . 19850 2 130 . 1 1 70 70 ASN N N 15 111.66 . . . . . . A 134 ASN N . 19850 2 131 . 1 1 71 71 TRP H H 1 9.7 . . . . . . A 135 TRP H . 19850 2 132 . 1 1 71 71 TRP N N 15 128.06 . . . . . . A 135 TRP N . 19850 2 133 . 1 1 73 73 THR H H 1 6.3 . . . . . . A 137 THR H . 19850 2 134 . 1 1 73 73 THR N N 15 106.58 . . . . . . A 137 THR N . 19850 2 135 . 1 1 76 76 GLN H H 1 9.36 . . . . . . A 140 GLN H . 19850 2 136 . 1 1 76 76 GLN N N 15 117.96 . . . . . . A 140 GLN N . 19850 2 137 . 1 1 77 77 LEU H H 1 8.43 . . . . . . A 141 LEU H . 19850 2 138 . 1 1 77 77 LEU N N 15 126.34 . . . . . . A 141 LEU N . 19850 2 139 . 1 1 78 78 TYR H H 1 9.79 . . . . . . A 142 TYR H . 19850 2 140 . 1 1 78 78 TYR N N 15 130.14 . . . . . . A 142 TYR N . 19850 2 141 . 1 1 79 79 ILE H H 1 8.51 . . . . . . A 143 ILE H . 19850 2 142 . 1 1 79 79 ILE N N 15 118.5 . . . . . . A 143 ILE N . 19850 2 143 . 1 1 80 80 GLY H H 1 10.17 . . . . . . A 144 GLY H . 19850 2 144 . 1 1 80 80 GLY N N 15 118.47 . . . . . . A 144 GLY N . 19850 2 145 . 1 1 81 81 GLY H H 1 9.5 . . . . . . A 145 GLY H . 19850 2 146 . 1 1 81 81 GLY N N 15 106.38 . . . . . . A 145 GLY N . 19850 2 147 . 1 1 82 82 GLU H H 1 7.88 . . . . . . A 146 GLU H . 19850 2 148 . 1 1 82 82 GLU N N 15 118.06 . . . . . . A 146 GLU N . 19850 2 149 . 1 1 83 83 PHE H H 1 8.97 . . . . . . A 147 PHE H . 19850 2 150 . 1 1 83 83 PHE N N 15 127.14 . . . . . . A 147 PHE N . 19850 2 151 . 1 1 84 84 PHE H H 1 8.98 . . . . . . A 148 PHE H . 19850 2 152 . 1 1 84 84 PHE N N 15 130.62 . . . . . . A 148 PHE N . 19850 2 153 . 1 1 85 85 GLY H H 1 8.5 . . . . . . A 149 GLY H . 19850 2 154 . 1 1 85 85 GLY N N 15 110.71 . . . . . . A 149 GLY N . 19850 2 155 . 1 1 86 86 GLY H H 1 8.42 . . . . . . A 150 GLY H . 19850 2 156 . 1 1 86 86 GLY N N 15 110.33 . . . . . . A 150 GLY N . 19850 2 157 . 1 1 87 87 CYS H H 1 8.3 . . . . . . A 151 CYS H . 19850 2 158 . 1 1 87 87 CYS N N 15 110.42 . . . . . . A 151 CYS N . 19850 2 159 . 1 1 88 88 ASP H H 1 7.78 . . . . . . A 152 ASP H . 19850 2 160 . 1 1 88 88 ASP N N 15 116.74 . . . . . . A 152 ASP N . 19850 2 161 . 1 1 89 89 ILE H H 1 8.4 . . . . . . A 153 ILE H . 19850 2 162 . 1 1 89 89 ILE N N 15 119.29 . . . . . . A 153 ILE N . 19850 2 163 . 1 1 90 90 THR H H 1 7.69 . . . . . . A 154 THR H . 19850 2 164 . 1 1 90 90 THR N N 15 118.86 . . . . . . A 154 THR N . 19850 2 165 . 1 1 91 91 LEU H H 1 8.49 . . . . . . A 155 LEU H . 19850 2 166 . 1 1 91 91 LEU N N 15 121.28 . . . . . . A 155 LEU N . 19850 2 167 . 1 1 92 92 GLU H H 1 7.68 . . . . . . A 156 GLU H . 19850 2 168 . 1 1 92 92 GLU N N 15 119.33 . . . . . . A 156 GLU N . 19850 2 169 . 1 1 93 93 ALA H H 1 8.4 . . . . . . A 157 ALA H . 19850 2 170 . 1 1 93 93 ALA N N 15 121.9 . . . . . . A 157 ALA N . 19850 2 171 . 1 1 94 94 PHE H H 1 8.45 . . . . . . A 158 PHE H . 19850 2 172 . 1 1 94 94 PHE N N 15 121.93 . . . . . . A 158 PHE N . 19850 2 173 . 1 1 95 95 LYS H H 1 7.69 . . . . . . A 159 LYS H . 19850 2 174 . 1 1 95 95 LYS N N 15 120.6 . . . . . . A 159 LYS N . 19850 2 175 . 1 1 96 96 THR H H 1 8.13 . . . . . . A 160 THR H . 19850 2 176 . 1 1 96 96 THR N N 15 106.9 . . . . . . A 160 THR N . 19850 2 177 . 1 1 97 97 GLY H H 1 7.39 . . . . . . A 161 GLY H . 19850 2 178 . 1 1 97 97 GLY N N 15 109.55 . . . . . . A 161 GLY N . 19850 2 179 . 1 1 98 98 GLU H H 1 8.24 . . . . . . A 162 GLU H . 19850 2 180 . 1 1 98 98 GLU N N 15 123.75 . . . . . . A 162 GLU N . 19850 2 181 . 1 1 99 99 LEU H H 1 8.14 . . . . . . A 163 LEU H . 19850 2 182 . 1 1 99 99 LEU N N 15 120.34 . . . . . . A 163 LEU N . 19850 2 183 . 1 1 100 100 GLN H H 1 9.51 . . . . . . A 164 GLN H . 19850 2 184 . 1 1 100 100 GLN N N 15 120.98 . . . . . . A 164 GLN N . 19850 2 185 . 1 1 101 101 GLU H H 1 7.27 . . . . . . A 165 GLU H . 19850 2 186 . 1 1 101 101 GLU N N 15 116.33 . . . . . . A 165 GLU N . 19850 2 187 . 1 1 102 102 GLU H H 1 7.98 . . . . . . A 166 GLU H . 19850 2 188 . 1 1 102 102 GLU N N 15 119.71 . . . . . . A 166 GLU N . 19850 2 189 . 1 1 103 103 VAL H H 1 8.54 . . . . . . A 167 VAL H . 19850 2 190 . 1 1 103 103 VAL N N 15 118.74 . . . . . . A 167 VAL N . 19850 2 191 . 1 1 104 104 GLU H H 1 7.62 . . . . . . A 168 GLU H . 19850 2 192 . 1 1 104 104 GLU N N 15 118.74 . . . . . . A 168 GLU N . 19850 2 193 . 1 1 105 105 LYS H H 1 7.77 . . . . . . A 169 LYS H . 19850 2 194 . 1 1 105 105 LYS N N 15 118.65 . . . . . . A 169 LYS N . 19850 2 195 . 1 1 106 106 ALA H H 1 7.07 . . . . . . A 170 ALA H . 19850 2 196 . 1 1 106 106 ALA N N 15 121.09 . . . . . . A 170 ALA N . 19850 2 197 . 1 1 107 107 MET H H 1 8.17 . . . . . . A 171 MET H . 19850 2 198 . 1 1 107 107 MET N N 15 114.27 . . . . . . A 171 MET N . 19850 2 199 . 1 1 108 108 CYS H H 1 7.78 . . . . . . A 172 CYS H . 19850 2 200 . 1 1 108 108 CYS N N 15 116.74 . . . . . . A 172 CYS N . 19850 2 201 . 1 1 109 109 SER H H 1 7.57 . . . . . . A 173 SER H . 19850 2 202 . 1 1 109 109 SER N N 15 122.89 . . . . . . A 173 SER N . 19850 2 stop_ save_ save_BOLA2_assigned_chem_shifts _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode BOLA2_assigned_chem_shifts _Assigned_chem_shift_list.Entry_ID 19850 _Assigned_chem_shift_list.ID 3 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 4 '2D 1H-15N HSQC' 4 $sample_4 . 19850 3 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 2 2 1 1 VAL H H 1 8.67 . . . . . . B 2 VAL H . 19850 3 2 . 2 2 1 1 VAL N N 15 120.45 . . . . . . B 2 VAL N . 19850 3 3 . 2 2 2 2 THR H H 1 7.68 . . . . . . B 3 THR H . 19850 3 4 . 2 2 2 2 THR N N 15 113.40 . . . . . . B 3 THR N . 19850 3 5 . 2 2 3 3 LYS H H 1 9.10 . . . . . . B 4 LYS H . 19850 3 6 . 2 2 3 3 LYS N N 15 121.99 . . . . . . B 4 LYS N . 19850 3 7 . 2 2 4 4 GLU H H 1 8.78 . . . . . . B 5 GLU H . 19850 3 8 . 2 2 4 4 GLU N N 15 117.64 . . . . . . B 5 GLU N . 19850 3 9 . 2 2 5 5 GLN H H 1 7.81 . . . . . . B 6 GLN H . 19850 3 10 . 2 2 5 5 GLN N N 15 122.08 . . . . . . B 6 GLN N . 19850 3 11 . 2 2 6 6 VAL H H 1 7.38 . . . . . . B 7 VAL H . 19850 3 12 . 2 2 6 6 VAL N N 15 120.01 . . . . . . B 7 VAL N . 19850 3 13 . 2 2 7 7 GLU H H 1 8.46 . . . . . . B 8 GLU H . 19850 3 14 . 2 2 7 7 GLU N N 15 117.25 . . . . . . B 8 GLU N . 19850 3 15 . 2 2 8 8 ALA H H 1 8.26 . . . . . . B 9 ALA H . 19850 3 16 . 2 2 8 8 ALA N N 15 114.29 . . . . . . B 9 ALA N . 19850 3 17 . 2 2 9 9 SER H H 1 8.28 . . . . . . B 10 SER H . 19850 3 18 . 2 2 9 9 SER N N 15 114.79 . . . . . . B 10 SER N . 19850 3 19 . 2 2 10 10 LEU H H 1 7.92 . . . . . . B 11 LEU H . 19850 3 20 . 2 2 10 10 LEU N N 15 118.29 . . . . . . B 11 LEU N . 19850 3 21 . 2 2 11 11 THR H H 1 8.38 . . . . . . B 12 THR H . 19850 3 22 . 2 2 11 11 THR N N 15 116.37 . . . . . . B 12 THR N . 19850 3 23 . 2 2 12 12 SER H H 1 7.96 . . . . . . B 13 SER H . 19850 3 24 . 2 2 12 12 SER N N 15 115.12 . . . . . . B 13 SER N . 19850 3 25 . 2 2 13 13 LYS H H 1 7.41 . . . . . . B 14 LYS H . 19850 3 26 . 2 2 13 13 LYS N N 15 116.04 . . . . . . B 14 LYS N . 19850 3 27 . 2 2 14 14 LEU H H 1 7.79 . . . . . . B 15 LEU H . 19850 3 28 . 2 2 14 14 LEU N N 15 114.41 . . . . . . B 15 LEU N . 19850 3 29 . 2 2 15 15 LYS H H 1 7.37 . . . . . . B 16 LYS H . 19850 3 30 . 2 2 15 15 LYS N N 15 116.47 . . . . . . B 16 LYS N . 19850 3 31 . 2 2 17 17 ILE H H 1 7.87 . . . . . . B 18 ILE H . 19850 3 32 . 2 2 17 17 ILE N N 15 116.66 . . . . . . B 18 ILE N . 19850 3 33 . 2 2 18 18 HIS H H 1 6.90 . . . . . . B 19 HIS H . 19850 3 34 . 2 2 18 18 HIS N N 15 118.50 . . . . . . B 19 HIS N . 19850 3 35 . 2 2 19 19 LEU H H 1 7.57 . . . . . . B 20 LEU H . 19850 3 36 . 2 2 19 19 LEU N N 15 128.24 . . . . . . B 20 LEU N . 19850 3 37 . 2 2 20 20 GLU H H 1 8.63 . . . . . . B 21 GLU H . 19850 3 38 . 2 2 20 20 GLU N N 15 126.08 . . . . . . B 21 GLU N . 19850 3 39 . 2 2 21 21 VAL H H 1 8.91 . . . . . . B 22 VAL H . 19850 3 40 . 2 2 21 21 VAL N N 15 127.08 . . . . . . B 22 VAL N . 19850 3 41 . 2 2 22 22 ILE H H 1 9.05 . . . . . . B 23 ILE H . 19850 3 42 . 2 2 22 22 ILE N N 15 126.13 . . . . . . B 23 ILE N . 19850 3 43 . 2 2 23 23 ASP H H 1 9.09 . . . . . . B 24 ASP H . 19850 3 44 . 2 2 23 23 ASP N N 15 127.04 . . . . . . B 24 ASP N . 19850 3 45 . 2 2 24 24 ILE H H 1 7.87 . . . . . . B 25 ILE H . 19850 3 46 . 2 2 24 24 ILE N N 15 123.13 . . . . . . B 25 ILE N . 19850 3 47 . 2 2 25 25 SER H H 1 9.11 . . . . . . B 26 SER H . 19850 3 48 . 2 2 25 25 SER N N 15 119.35 . . . . . . B 26 SER N . 19850 3 49 . 2 2 26 26 GLY H H 1 8.36 . . . . . . B 27 GLY H . 19850 3 50 . 2 2 26 26 GLY N N 15 111.92 . . . . . . B 27 GLY N . 19850 3 51 . 2 2 27 27 GLY H H 1 7.83 . . . . . . B 28 GLY H . 19850 3 52 . 2 2 27 27 GLY N N 15 107.07 . . . . . . B 28 GLY N . 19850 3 53 . 2 2 28 28 CYS H H 1 7.33 . . . . . . B 29 CYS H . 19850 3 54 . 2 2 28 28 CYS N N 15 116.90 . . . . . . B 29 CYS N . 19850 3 55 . 2 2 29 29 GLY H H 1 8.86 . . . . . . B 30 GLY H . 19850 3 56 . 2 2 29 29 GLY N N 15 111.52 . . . . . . B 30 GLY N . 19850 3 57 . 2 2 30 30 SER H H 1 8.18 . . . . . . B 31 SER H . 19850 3 58 . 2 2 30 30 SER N N 15 111.93 . . . . . . B 31 SER N . 19850 3 59 . 2 2 31 31 SER H H 1 7.21 . . . . . . B 32 SER H . 19850 3 60 . 2 2 31 31 SER N N 15 116.19 . . . . . . B 32 SER N . 19850 3 61 . 2 2 32 32 PHE H H 1 7.93 . . . . . . B 33 PHE H . 19850 3 62 . 2 2 32 32 PHE N N 15 118.46 . . . . . . B 33 PHE N . 19850 3 63 . 2 2 33 33 GLU H H 1 9.37 . . . . . . B 34 GLU H . 19850 3 64 . 2 2 33 33 GLU N N 15 122.21 . . . . . . B 34 GLU N . 19850 3 65 . 2 2 34 34 VAL H H 1 8.72 . . . . . . B 35 VAL H . 19850 3 66 . 2 2 34 34 VAL N N 15 118.45 . . . . . . B 35 VAL N . 19850 3 67 . 2 2 35 35 GLU H H 1 8.80 . . . . . . B 36 GLU H . 19850 3 68 . 2 2 35 35 GLU N N 15 123.69 . . . . . . B 36 GLU N . 19850 3 69 . 2 2 36 36 VAL H H 1 8.44 . . . . . . B 37 VAL H . 19850 3 70 . 2 2 36 36 VAL N N 15 119.95 . . . . . . B 37 VAL N . 19850 3 71 . 2 2 37 37 VAL H H 1 8.14 . . . . . . B 38 VAL H . 19850 3 72 . 2 2 37 37 VAL N N 15 127.96 . . . . . . B 38 VAL N . 19850 3 73 . 2 2 38 38 SER H H 1 8.20 . . . . . . B 39 SER H . 19850 3 74 . 2 2 38 38 SER N N 15 117.33 . . . . . . B 39 SER N . 19850 3 75 . 2 2 39 39 GLU H H 1 9.83 . . . . . . B 40 GLU H . 19850 3 76 . 2 2 39 39 GLU N N 15 131.47 . . . . . . B 40 GLU N . 19850 3 77 . 2 2 40 40 GLN H H 1 8.16 . . . . . . B 41 GLN H . 19850 3 78 . 2 2 40 40 GLN N N 15 117.52 . . . . . . B 41 GLN N . 19850 3 79 . 2 2 41 41 PHE H H 1 6.83 . . . . . . B 42 PHE H . 19850 3 80 . 2 2 41 41 PHE N N 15 113.28 . . . . . . B 42 PHE N . 19850 3 81 . 2 2 42 42 GLU H H 1 7.41 . . . . . . B 43 GLU H . 19850 3 82 . 2 2 42 42 GLU N N 15 121.16 . . . . . . B 43 GLU N . 19850 3 83 . 2 2 43 43 GLY H H 1 8.96 . . . . . . B 44 GLY H . 19850 3 84 . 2 2 43 43 GLY N N 15 114.95 . . . . . . B 44 GLY N . 19850 3 85 . 2 2 44 44 LYS H H 1 7.87 . . . . . . B 45 LYS H . 19850 3 86 . 2 2 44 44 LYS N N 15 118.69 . . . . . . B 45 LYS N . 19850 3 87 . 2 2 45 45 ARG H H 1 9.23 . . . . . . B 46 ARG H . 19850 3 88 . 2 2 45 45 ARG N N 15 125.42 . . . . . . B 46 ARG N . 19850 3 89 . 2 2 46 46 LEU H H 1 6.91 . . . . . . B 47 LEU H . 19850 3 90 . 2 2 46 46 LEU N N 15 118.20 . . . . . . B 47 LEU N . 19850 3 91 . 2 2 47 47 LEU H H 1 8.53 . . . . . . B 48 LEU H . 19850 3 92 . 2 2 47 47 LEU N N 15 115.69 . . . . . . B 48 LEU N . 19850 3 93 . 2 2 48 48 GLU H H 1 8.21 . . . . . . B 49 GLU H . 19850 3 94 . 2 2 48 48 GLU N N 15 120.89 . . . . . . B 49 GLU N . 19850 3 95 . 2 2 49 49 ARG H H 1 7.93 . . . . . . B 50 ARG H . 19850 3 96 . 2 2 49 49 ARG N N 15 119.72 . . . . . . B 50 ARG N . 19850 3 97 . 2 2 50 50 HIS H H 1 8.25 . . . . . . B 51 HIS H . 19850 3 98 . 2 2 50 50 HIS N N 15 117.12 . . . . . . B 51 HIS N . 19850 3 99 . 2 2 51 51 ARG H H 1 7.93 . . . . . . B 52 ARG H . 19850 3 100 . 2 2 51 51 ARG N N 15 120.36 . . . . . . B 52 ARG N . 19850 3 101 . 2 2 52 52 MET H H 1 8.11 . . . . . . B 53 MET H . 19850 3 102 . 2 2 52 52 MET N N 15 120.72 . . . . . . B 53 MET N . 19850 3 103 . 2 2 53 53 VAL H H 1 8.10 . . . . . . B 54 VAL H . 19850 3 104 . 2 2 53 53 VAL N N 15 119.09 . . . . . . B 54 VAL N . 19850 3 105 . 2 2 54 54 ASN H H 1 7.97 . . . . . . B 55 ASN H . 19850 3 106 . 2 2 54 54 ASN N N 15 116.86 . . . . . . B 55 ASN N . 19850 3 107 . 2 2 55 55 ALA H H 1 8.52 . . . . . . B 56 ALA H . 19850 3 108 . 2 2 55 55 ALA N N 15 121.14 . . . . . . B 56 ALA N . 19850 3 109 . 2 2 56 56 ALA H H 1 7.56 . . . . . . B 57 ALA H . 19850 3 110 . 2 2 56 56 ALA N N 15 121.20 . . . . . . B 57 ALA N . 19850 3 111 . 2 2 57 57 LEU H H 1 6.93 . . . . . . B 58 LEU H . 19850 3 112 . 2 2 57 57 LEU N N 15 116.13 . . . . . . B 58 LEU N . 19850 3 113 . 2 2 58 58 GLU H H 1 6.96 . . . . . . B 59 GLU H . 19850 3 114 . 2 2 58 58 GLU N N 15 120.17 . . . . . . B 59 GLU N . 19850 3 115 . 2 2 59 59 GLU H H 1 8.55 . . . . . . B 60 GLU H . 19850 3 116 . 2 2 59 59 GLU N N 15 116.27 . . . . . . B 60 GLU N . 19850 3 117 . 2 2 60 60 GLU H H 1 8.97 . . . . . . B 61 GLU H . 19850 3 118 . 2 2 60 60 GLU N N 15 121.85 . . . . . . B 61 GLU N . 19850 3 119 . 2 2 61 61 MET H H 1 8.70 . . . . . . B 62 MET H . 19850 3 120 . 2 2 61 61 MET N N 15 115.95 . . . . . . B 62 MET N . 19850 3 121 . 2 2 62 62 LYS H H 1 7.37 . . . . . . B 63 LYS H . 19850 3 122 . 2 2 62 62 LYS N N 15 116.98 . . . . . . B 63 LYS N . 19850 3 123 . 2 2 63 63 GLU H H 1 7.72 . . . . . . B 64 GLU H . 19850 3 124 . 2 2 63 63 GLU N N 15 115.49 . . . . . . B 64 GLU N . 19850 3 125 . 2 2 64 64 ILE H H 1 7.40 . . . . . . B 65 ILE H . 19850 3 126 . 2 2 64 64 ILE N N 15 120.57 . . . . . . B 65 ILE N . 19850 3 127 . 2 2 65 65 HIS H H 1 9.12 . . . . . . B 66 HIS H . 19850 3 128 . 2 2 65 65 HIS N N 15 126.62 . . . . . . B 66 HIS N . 19850 3 129 . 2 2 66 66 ALA H H 1 7.40 . . . . . . B 67 ALA H . 19850 3 130 . 2 2 66 66 ALA N N 15 120.57 . . . . . . B 67 ALA N . 19850 3 131 . 2 2 67 67 LEU H H 1 8.50 . . . . . . B 68 LEU H . 19850 3 132 . 2 2 67 67 LEU N N 15 124.53 . . . . . . B 68 LEU N . 19850 3 133 . 2 2 68 68 SER H H 1 8.80 . . . . . . B 69 SER H . 19850 3 134 . 2 2 68 68 SER N N 15 122.06 . . . . . . B 69 SER N . 19850 3 135 . 2 2 69 69 ILE H H 1 8.85 . . . . . . B 70 ILE H . 19850 3 136 . 2 2 69 69 ILE N N 15 129.11 . . . . . . B 70 ILE N . 19850 3 137 . 2 2 70 70 LYS H H 1 8.64 . . . . . . B 71 LYS H . 19850 3 138 . 2 2 70 70 LYS N N 15 130.03 . . . . . . B 71 LYS N . 19850 3 139 . 2 2 71 71 LYS H H 1 7.16 . . . . . . B 72 LYS H . 19850 3 140 . 2 2 71 71 LYS N N 15 113.93 . . . . . . B 72 LYS N . 19850 3 141 . 2 2 72 72 ALA H H 1 8.79 . . . . . . B 73 ALA H . 19850 3 142 . 2 2 72 72 ALA N N 15 129.18 . . . . . . B 73 ALA N . 19850 3 143 . 2 2 73 73 GLN H H 1 8.29 . . . . . . B 74 GLN H . 19850 3 144 . 2 2 73 73 GLN N N 15 120.84 . . . . . . B 74 GLN N . 19850 3 145 . 2 2 74 74 THR H H 1 8.84 . . . . . . B 75 THR H . 19850 3 146 . 2 2 74 74 THR N N 15 111.78 . . . . . . B 75 THR N . 19850 3 147 . 2 2 76 76 GLN H H 1 7.45 . . . . . . B 77 GLN H . 19850 3 148 . 2 2 76 76 GLN N N 15 116.81 . . . . . . B 77 GLN N . 19850 3 149 . 2 2 77 77 GLN H H 1 8.42 . . . . . . B 78 GLN H . 19850 3 150 . 2 2 77 77 GLN N N 15 114.28 . . . . . . B 78 GLN N . 19850 3 151 . 2 2 78 78 TRP H H 1 7.63 . . . . . . B 79 TRP H . 19850 3 152 . 2 2 78 78 TRP N N 15 120.58 . . . . . . B 79 TRP N . 19850 3 153 . 2 2 79 79 LYS H H 1 7.72 . . . . . . B 80 LYS H . 19850 3 154 . 2 2 79 79 LYS N N 15 120.81 . . . . . . B 80 LYS N . 19850 3 stop_ save_ save_BOLA2-GRXS14 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode BOLA2-GRXS14 _Assigned_chem_shift_list.Entry_ID 19850 _Assigned_chem_shift_list.ID 4 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' 1 $sample_1 . 19850 4 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 2 2 1 1 VAL H H 1 8.67 . . . . . . B 2 VAL H . 19850 4 2 . 2 2 1 1 VAL N N 15 120.41 . . . . . . B 2 VAL N . 19850 4 3 . 2 2 2 2 THR H H 1 7.68 . . . . . . B 3 THR H . 19850 4 4 . 2 2 2 2 THR N N 15 113.40 . . . . . . B 3 THR N . 19850 4 5 . 2 2 3 3 LYS H H 1 9.11 . . . . . . B 4 LYS H . 19850 4 6 . 2 2 3 3 LYS N N 15 121.99 . . . . . . B 4 LYS N . 19850 4 7 . 2 2 4 4 GLU H H 1 8.78 . . . . . . B 5 GLU H . 19850 4 8 . 2 2 4 4 GLU N N 15 117.64 . . . . . . B 5 GLU N . 19850 4 9 . 2 2 5 5 GLN H H 1 7.81 . . . . . . B 6 GLN H . 19850 4 10 . 2 2 5 5 GLN N N 15 122.08 . . . . . . B 6 GLN N . 19850 4 11 . 2 2 6 6 VAL H H 1 7.40 . . . . . . B 7 VAL H . 19850 4 12 . 2 2 6 6 VAL N N 15 120.00 . . . . . . B 7 VAL N . 19850 4 13 . 2 2 7 7 GLU H H 1 8.46 . . . . . . B 8 GLU H . 19850 4 14 . 2 2 7 7 GLU N N 15 117.25 . . . . . . B 8 GLU N . 19850 4 15 . 2 2 8 8 ALA H H 1 8.25 . . . . . . B 9 ALA H . 19850 4 16 . 2 2 8 8 ALA N N 15 124.29 . . . . . . B 9 ALA N . 19850 4 17 . 2 2 9 9 SER H H 1 8.28 . . . . . . B 10 SER H . 19850 4 18 . 2 2 9 9 SER N N 15 114.79 . . . . . . B 10 SER N . 19850 4 19 . 2 2 10 10 LEU H H 1 7.91 . . . . . . B 11 LEU H . 19850 4 20 . 2 2 10 10 LEU N N 15 118.30 . . . . . . B 11 LEU N . 19850 4 21 . 2 2 11 11 THR H H 1 8.38 . . . . . . B 12 THR H . 19850 4 22 . 2 2 11 11 THR N N 15 116.37 . . . . . . B 12 THR N . 19850 4 23 . 2 2 12 12 SER H H 1 7.96 . . . . . . B 13 SER H . 19850 4 24 . 2 2 12 12 SER N N 15 115.12 . . . . . . B 13 SER N . 19850 4 25 . 2 2 13 13 LYS H H 1 7.39 . . . . . . B 14 LYS H . 19850 4 26 . 2 2 13 13 LYS N N 15 116.01 . . . . . . B 14 LYS N . 19850 4 27 . 2 2 14 14 LEU H H 1 7.78 . . . . . . B 15 LEU H . 19850 4 28 . 2 2 14 14 LEU N N 15 114.34 . . . . . . B 15 LEU N . 19850 4 29 . 2 2 15 15 LYS H H 1 7.37 . . . . . . B 16 LYS H . 19850 4 30 . 2 2 15 15 LYS N N 15 116.47 . . . . . . B 16 LYS N . 19850 4 31 . 2 2 17 17 ILE H H 1 7.87 . . . . . . B 18 ILE H . 19850 4 32 . 2 2 17 17 ILE N N 15 116.76 . . . . . . B 18 ILE N . 19850 4 33 . 2 2 18 18 HIS H H 1 6.90 . . . . . . B 19 HIS H . 19850 4 34 . 2 2 18 18 HIS N N 15 118.50 . . . . . . B 19 HIS N . 19850 4 35 . 2 2 19 19 LEU H H 1 7.57 . . . . . . B 20 LEU H . 19850 4 36 . 2 2 19 19 LEU N N 15 128.24 . . . . . . B 20 LEU N . 19850 4 37 . 2 2 20 20 GLU H H 1 8.62 . . . . . . B 21 GLU H . 19850 4 38 . 2 2 20 20 GLU N N 15 125.99 . . . . . . B 21 GLU N . 19850 4 39 . 2 2 21 21 VAL H H 1 8.90 . . . . . . B 22 VAL H . 19850 4 40 . 2 2 21 21 VAL N N 15 127.00 . . . . . . B 22 VAL N . 19850 4 41 . 2 2 22 22 ILE H H 1 9.06 . . . . . . B 23 ILE H . 19850 4 42 . 2 2 22 22 ILE N N 15 126.18 . . . . . . B 23 ILE N . 19850 4 43 . 2 2 23 23 ASP H H 1 9.09 . . . . . . B 24 ASP H . 19850 4 44 . 2 2 23 23 ASP N N 15 127.04 . . . . . . B 24 ASP N . 19850 4 45 . 2 2 24 24 ILE H H 1 7.87 . . . . . . B 25 ILE H . 19850 4 46 . 2 2 24 24 ILE N N 15 123.16 . . . . . . B 25 ILE N . 19850 4 47 . 2 2 25 25 SER H H 1 9.11 . . . . . . B 26 SER H . 19850 4 48 . 2 2 25 25 SER N N 15 119.35 . . . . . . B 26 SER N . 19850 4 49 . 2 2 26 26 GLY H H 1 8.37 . . . . . . B 27 GLY H . 19850 4 50 . 2 2 26 26 GLY N N 15 111.77 . . . . . . B 27 GLY N . 19850 4 51 . 2 2 27 27 GLY H H 1 7.83 . . . . . . B 28 GLY H . 19850 4 52 . 2 2 27 27 GLY N N 15 107.07 . . . . . . B 28 GLY N . 19850 4 53 . 2 2 28 28 CYS H H 1 7.34 . . . . . . B 29 CYS H . 19850 4 54 . 2 2 28 28 CYS N N 15 116.85 . . . . . . B 29 CYS N . 19850 4 55 . 2 2 29 29 GLY H H 1 8.86 . . . . . . B 30 GLY H . 19850 4 56 . 2 2 29 29 GLY N N 15 111.55 . . . . . . B 30 GLY N . 19850 4 57 . 2 2 30 30 SER H H 1 8.19 . . . . . . B 31 SER H . 19850 4 58 . 2 2 30 30 SER N N 15 111.94 . . . . . . B 31 SER N . 19850 4 59 . 2 2 31 31 SER H H 1 7.22 . . . . . . B 32 SER H . 19850 4 60 . 2 2 31 31 SER N N 15 116.25 . . . . . . B 32 SER N . 19850 4 61 . 2 2 32 32 PHE H H 1 7.93 . . . . . . B 33 PHE H . 19850 4 62 . 2 2 32 32 PHE N N 15 118.42 . . . . . . B 33 PHE N . 19850 4 63 . 2 2 33 33 GLU H H 1 9.36 . . . . . . B 34 GLU H . 19850 4 64 . 2 2 33 33 GLU N N 15 121.99 . . . . . . B 34 GLU N . 19850 4 65 . 2 2 34 34 VAL H H 1 8.74 . . . . . . B 35 VAL H . 19850 4 66 . 2 2 34 34 VAL N N 15 118.31 . . . . . . B 35 VAL N . 19850 4 67 . 2 2 35 35 GLU H H 1 8.78 . . . . . . B 36 GLU H . 19850 4 68 . 2 2 35 35 GLU N N 15 123.56 . . . . . . B 36 GLU N . 19850 4 69 . 2 2 36 36 VAL H H 1 8.44 . . . . . . B 37 VAL H . 19850 4 70 . 2 2 36 36 VAL N N 15 120.01 . . . . . . B 37 VAL N . 19850 4 71 . 2 2 37 37 VAL H H 1 8.12 . . . . . . B 38 VAL H . 19850 4 72 . 2 2 37 37 VAL N N 15 127.84 . . . . . . B 38 VAL N . 19850 4 73 . 2 2 38 38 SER H H 1 8.18 . . . . . . B 39 SER H . 19850 4 74 . 2 2 38 38 SER N N 15 117.47 . . . . . . B 39 SER N . 19850 4 75 . 2 2 39 39 GLU H H 1 9.83 . . . . . . B 40 GLU H . 19850 4 76 . 2 2 39 39 GLU N N 15 131.47 . . . . . . B 40 GLU N . 19850 4 77 . 2 2 40 40 GLN H H 1 8.16 . . . . . . B 41 GLN H . 19850 4 78 . 2 2 40 40 GLN N N 15 117.52 . . . . . . B 41 GLN N . 19850 4 79 . 2 2 41 41 PHE H H 1 6.83 . . . . . . B 42 PHE H . 19850 4 80 . 2 2 41 41 PHE N N 15 113.28 . . . . . . B 42 PHE N . 19850 4 81 . 2 2 42 42 GLU H H 1 7.40 . . . . . . B 43 GLU H . 19850 4 82 . 2 2 42 42 GLU N N 15 120.96 . . . . . . B 43 GLU N . 19850 4 83 . 2 2 43 43 GLY H H 1 8.96 . . . . . . B 44 GLY H . 19850 4 84 . 2 2 43 43 GLY N N 15 114.95 . . . . . . B 44 GLY N . 19850 4 85 . 2 2 44 44 LYS H H 1 7.85 . . . . . . B 45 LYS H . 19850 4 86 . 2 2 44 44 LYS N N 15 118.68 . . . . . . B 45 LYS N . 19850 4 87 . 2 2 45 45 ARG H H 1 9.21 . . . . . . B 46 ARG H . 19850 4 88 . 2 2 45 45 ARG N N 15 125.33 . . . . . . B 46 ARG N . 19850 4 89 . 2 2 46 46 LEU H H 1 6.91 . . . . . . B 47 LEU H . 19850 4 90 . 2 2 46 46 LEU N N 15 118.20 . . . . . . B 47 LEU N . 19850 4 91 . 2 2 47 47 LEU H H 1 8.52 . . . . . . B 48 LEU H . 19850 4 92 . 2 2 47 47 LEU N N 15 116.00 . . . . . . B 48 LEU N . 19850 4 93 . 2 2 48 48 GLU H H 1 8.22 . . . . . . B 49 GLU H . 19850 4 94 . 2 2 48 48 GLU N N 15 120.86 . . . . . . B 49 GLU N . 19850 4 95 . 2 2 49 49 ARG H H 1 7.94 . . . . . . B 50 ARG H . 19850 4 96 . 2 2 49 49 ARG N N 15 119.23 . . . . . . B 50 ARG N . 19850 4 97 . 2 2 50 50 HIS H H 1 8.30 . . . . . . B 51 HIS H . 19850 4 98 . 2 2 50 50 HIS N N 15 117.47 . . . . . . B 51 HIS N . 19850 4 99 . 2 2 51 51 ARG H H 1 7.93 . . . . . . B 52 ARG H . 19850 4 100 . 2 2 51 51 ARG N N 15 120.36 . . . . . . B 52 ARG N . 19850 4 101 . 2 2 52 52 MET H H 1 8.11 . . . . . . B 53 MET H . 19850 4 102 . 2 2 52 52 MET N N 15 120.72 . . . . . . B 53 MET N . 19850 4 103 . 2 2 53 53 VAL H H 1 8.09 . . . . . . B 54 VAL H . 19850 4 104 . 2 2 53 53 VAL N N 15 119.34 . . . . . . B 54 VAL N . 19850 4 105 . 2 2 54 54 ASN H H 1 7.96 . . . . . . B 55 ASN H . 19850 4 106 . 2 2 54 54 ASN N N 15 116.94 . . . . . . B 55 ASN N . 19850 4 107 . 2 2 55 55 ALA H H 1 8.47 . . . . . . B 56 ALA H . 19850 4 108 . 2 2 55 55 ALA N N 15 121.06 . . . . . . B 56 ALA N . 19850 4 109 . 2 2 56 56 ALA H H 1 7.57 . . . . . . B 57 ALA H . 19850 4 110 . 2 2 56 56 ALA N N 15 121.34 . . . . . . B 57 ALA N . 19850 4 111 . 2 2 57 57 LEU H H 1 6.93 . . . . . . B 58 LEU H . 19850 4 112 . 2 2 57 57 LEU N N 15 116.00 . . . . . . B 58 LEU N . 19850 4 113 . 2 2 58 58 GLU H H 1 6.95 . . . . . . B 59 GLU H . 19850 4 114 . 2 2 58 58 GLU N N 15 120.17 . . . . . . B 59 GLU N . 19850 4 115 . 2 2 59 59 GLU H H 1 8.55 . . . . . . B 60 GLU H . 19850 4 116 . 2 2 59 59 GLU N N 15 116.27 . . . . . . B 60 GLU N . 19850 4 117 . 2 2 60 60 GLU H H 1 8.98 . . . . . . B 61 GLU H . 19850 4 118 . 2 2 60 60 GLU N N 15 121.90 . . . . . . B 61 GLU N . 19850 4 119 . 2 2 61 61 MET H H 1 8.69 . . . . . . B 62 MET H . 19850 4 120 . 2 2 61 61 MET N N 15 115.95 . . . . . . B 62 MET N . 19850 4 121 . 2 2 62 62 LYS H H 1 7.37 . . . . . . B 63 LYS H . 19850 4 122 . 2 2 62 62 LYS N N 15 116.98 . . . . . . B 63 LYS N . 19850 4 123 . 2 2 63 63 GLU H H 1 7.72 . . . . . . B 64 GLU H . 19850 4 124 . 2 2 63 63 GLU N N 15 115.49 . . . . . . B 64 GLU N . 19850 4 125 . 2 2 64 64 ILE H H 1 7.39 . . . . . . B 65 ILE H . 19850 4 126 . 2 2 64 64 ILE N N 15 120.54 . . . . . . B 65 ILE N . 19850 4 127 . 2 2 65 65 HIS H H 1 9.13 . . . . . . B 66 HIS H . 19850 4 128 . 2 2 65 65 HIS N N 15 126.53 . . . . . . B 66 HIS N . 19850 4 129 . 2 2 66 66 ALA H H 1 7.39 . . . . . . B 67 ALA H . 19850 4 130 . 2 2 66 66 ALA N N 15 120.54 . . . . . . B 67 ALA N . 19850 4 131 . 2 2 67 67 LEU H H 1 8.47 . . . . . . B 68 LEU H . 19850 4 132 . 2 2 67 67 LEU N N 15 124.39 . . . . . . B 68 LEU N . 19850 4 133 . 2 2 68 68 SER H H 1 8.80 . . . . . . B 69 SER H . 19850 4 134 . 2 2 68 68 SER N N 15 122.19 . . . . . . B 69 SER N . 19850 4 135 . 2 2 69 69 ILE H H 1 8.87 . . . . . . B 70 ILE H . 19850 4 136 . 2 2 69 69 ILE N N 15 129.47 . . . . . . B 70 ILE N . 19850 4 137 . 2 2 70 70 LYS H H 1 8.64 . . . . . . B 71 LYS H . 19850 4 138 . 2 2 70 70 LYS N N 15 130.03 . . . . . . B 71 LYS N . 19850 4 139 . 2 2 71 71 LYS H H 1 7.14 . . . . . . B 72 LYS H . 19850 4 140 . 2 2 71 71 LYS N N 15 114.17 . . . . . . B 72 LYS N . 19850 4 141 . 2 2 72 72 ALA H H 1 8.79 . . . . . . B 73 ALA H . 19850 4 142 . 2 2 72 72 ALA N N 15 129.18 . . . . . . B 73 ALA N . 19850 4 143 . 2 2 73 73 GLN H H 1 8.24 . . . . . . B 74 GLN H . 19850 4 144 . 2 2 73 73 GLN N N 15 120.75 . . . . . . B 74 GLN N . 19850 4 145 . 2 2 74 74 THR H H 1 8.84 . . . . . . B 75 THR H . 19850 4 146 . 2 2 74 74 THR N N 15 111.71 . . . . . . B 75 THR N . 19850 4 147 . 2 2 76 76 GLN H H 1 7.45 . . . . . . B 77 GLN H . 19850 4 148 . 2 2 76 76 GLN N N 15 116.81 . . . . . . B 77 GLN N . 19850 4 149 . 2 2 77 77 GLN H H 1 8.41 . . . . . . B 78 GLN H . 19850 4 150 . 2 2 77 77 GLN N N 15 114.25 . . . . . . B 78 GLN N . 19850 4 151 . 2 2 78 78 TRP H H 1 7.62 . . . . . . B 79 TRP H . 19850 4 152 . 2 2 78 78 TRP N N 15 120.62 . . . . . . B 79 TRP N . 19850 4 153 . 2 2 79 79 LYS H H 1 7.72 . . . . . . B 80 LYS H . 19850 4 154 . 2 2 79 79 LYS N N 15 120.97 . . . . . . B 80 LYS N . 19850 4 stop_ save_