data_27437 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 27437 _Entry.Title ; 1H, 13CA, 13CB and 15N chemical shift assignments of b2-microglobulin and a-chain of the neonatal Fc receptor ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2018-03-29 _Entry.Accession_date 2018-03-29 _Entry.Last_release_date 2018-03-29 _Entry.Original_release_date 2018-03-29 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.0.16 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLID-STATE _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _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.ORCID _Entry_author.Entry_ID 1 Daniel Stoeppler . . . . 27437 2 Hartmut Oschkinat . . . . 27437 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 2 27437 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 173 27437 '15N chemical shifts' 89 27437 '1H chemical shifts' 89 27437 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 1 . . 2018-04-23 . original BMRB . 27437 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 27437 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title ; Insight into Small Molecule Binding to the Neonatal Fc Receptor by X-ray Crystallography and 100 kHz Magic-Angle-Spinning NMR ; _Citation.Status submitted _Citation.Type journal _Citation.Journal_abbrev 'PLOS Biology' _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _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 . _Citation.Page_last . _Citation.Year . _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.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Daniel Stoeppler . . . . 27437 1 2 Alex Macpherson . . . . 27437 1 3 Susanne Smith-Penzel . . . . 27437 1 4 Nicolas Basse . . . . 27437 1 5 Fabien Lecomte . . . . 27437 1 6 Herv Deboves . . . . 27437 1 7 Richard Taylor . D. . . 27437 1 8 Tim Norman . . . . 27437 1 9 John Porter . . . . 27437 1 10 Lorna Waters . . . . 27437 1 11 Marta Westwood . . . . 27437 1 12 Ben Cossins . . . . 27437 1 13 Katharine Cain . . . . 27437 1 14 James White . . . . 27437 1 15 Robert Griffin . . . . 27437 1 16 Christine Prosser . . . . 27437 1 17 Sebastian Kelm . . . . 27437 1 18 Amy Sullivan . H. . . 27437 1 19 David 'Fox III' . . . . 27437 1 20 Mark Carr . . . . 27437 1 21 Alistair Henry . . . . 27437 1 22 Richard Taylor . . . . 27437 1 23 Beat Meier . H. . . 27437 1 24 Hartmut Oschkinat . . . . 27437 1 25 Alastair Lawson . . . . 27437 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 27437 _Assembly.ID 1 _Assembly.Name FcRn _Assembly.BMRB_code . _Assembly.Number_of_components . _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 a-chain 1 $a-chain A . yes native no no . . . 27437 1 2 b2-microglobulin 2 $b2-microglobulin B . yes native no no . . . 27437 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_a-chain _Entity.Sf_category entity _Entity.Sf_framecode a-chain _Entity.Entry_ID 27437 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name a-chain _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; AESHLSLLYHLTAVSSPAPG TPAFWVSGWLGPQQYLSYNS LRGEAEPCGAWVWENQVSWY WEKETTDLRIKEKLFLEAFK ALGGKGPYTLQGLLGCELGP DNTSVPTAKFALNGEEFMNF DLKQGTWGGDWPEALAISQR WQQQDKAANKELTFLLFSCP HRLREHLERGRGNLEWKEPP SMRLKARPSSPGFSVLTCSA FSFYPPELQLRFLRNGLAAG TGQGDFGPNSDGSFHASSSL TVKSGDEHHYCCIVQHAGLA QPLRVELESPAKSS ; _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 274 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all disulfide bound' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . 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 . ALA . 27437 1 2 . GLU . 27437 1 3 . SER . 27437 1 4 . HIS . 27437 1 5 . LEU . 27437 1 6 . SER . 27437 1 7 . LEU . 27437 1 8 . LEU . 27437 1 9 . TYR . 27437 1 10 . HIS . 27437 1 11 . LEU . 27437 1 12 . THR . 27437 1 13 . ALA . 27437 1 14 . VAL . 27437 1 15 . SER . 27437 1 16 . SER . 27437 1 17 . PRO . 27437 1 18 . ALA . 27437 1 19 . PRO . 27437 1 20 . GLY . 27437 1 21 . THR . 27437 1 22 . PRO . 27437 1 23 . ALA . 27437 1 24 . PHE . 27437 1 25 . TRP . 27437 1 26 . VAL . 27437 1 27 . SER . 27437 1 28 . GLY . 27437 1 29 . TRP . 27437 1 30 . LEU . 27437 1 31 . GLY . 27437 1 32 . PRO . 27437 1 33 . GLN . 27437 1 34 . GLN . 27437 1 35 . TYR . 27437 1 36 . LEU . 27437 1 37 . SER . 27437 1 38 . TYR . 27437 1 39 . ASN . 27437 1 40 . SER . 27437 1 41 . LEU . 27437 1 42 . ARG . 27437 1 43 . GLY . 27437 1 44 . GLU . 27437 1 45 . ALA . 27437 1 46 . GLU . 27437 1 47 . PRO . 27437 1 48 . CYS . 27437 1 49 . GLY . 27437 1 50 . ALA . 27437 1 51 . TRP . 27437 1 52 . VAL . 27437 1 53 . TRP . 27437 1 54 . GLU . 27437 1 55 . ASN . 27437 1 56 . GLN . 27437 1 57 . VAL . 27437 1 58 . SER . 27437 1 59 . TRP . 27437 1 60 . TYR . 27437 1 61 . TRP . 27437 1 62 . GLU . 27437 1 63 . LYS . 27437 1 64 . GLU . 27437 1 65 . THR . 27437 1 66 . THR . 27437 1 67 . ASP . 27437 1 68 . LEU . 27437 1 69 . ARG . 27437 1 70 . ILE . 27437 1 71 . LYS . 27437 1 72 . GLU . 27437 1 73 . LYS . 27437 1 74 . LEU . 27437 1 75 . PHE . 27437 1 76 . LEU . 27437 1 77 . GLU . 27437 1 78 . ALA . 27437 1 79 . PHE . 27437 1 80 . LYS . 27437 1 81 . ALA . 27437 1 82 . LEU . 27437 1 83 . GLY . 27437 1 84 . GLY . 27437 1 85 . LYS . 27437 1 86 . GLY . 27437 1 87 . PRO . 27437 1 88 . TYR . 27437 1 89 . THR . 27437 1 90 . LEU . 27437 1 91 . GLN . 27437 1 92 . GLY . 27437 1 93 . LEU . 27437 1 94 . LEU . 27437 1 95 . GLY . 27437 1 96 . CYS . 27437 1 97 . GLU . 27437 1 98 . LEU . 27437 1 99 . GLY . 27437 1 100 . PRO . 27437 1 101 . ASP . 27437 1 102 . ASN . 27437 1 103 . THR . 27437 1 104 . SER . 27437 1 105 . VAL . 27437 1 106 . PRO . 27437 1 107 . THR . 27437 1 108 . ALA . 27437 1 109 . LYS . 27437 1 110 . PHE . 27437 1 111 . ALA . 27437 1 112 . LEU . 27437 1 113 . ASN . 27437 1 114 . GLY . 27437 1 115 . GLU . 27437 1 116 . GLU . 27437 1 117 . PHE . 27437 1 118 . MET . 27437 1 119 . ASN . 27437 1 120 . PHE . 27437 1 121 . ASP . 27437 1 122 . LEU . 27437 1 123 . LYS . 27437 1 124 . GLN . 27437 1 125 . GLY . 27437 1 126 . THR . 27437 1 127 . TRP . 27437 1 128 . GLY . 27437 1 129 . GLY . 27437 1 130 . ASP . 27437 1 131 . TRP . 27437 1 132 . PRO . 27437 1 133 . GLU . 27437 1 134 . ALA . 27437 1 135 . LEU . 27437 1 136 . ALA . 27437 1 137 . ILE . 27437 1 138 . SER . 27437 1 139 . GLN . 27437 1 140 . ARG . 27437 1 141 . TRP . 27437 1 142 . GLN . 27437 1 143 . GLN . 27437 1 144 . GLN . 27437 1 145 . ASP . 27437 1 146 . LYS . 27437 1 147 . ALA . 27437 1 148 . ALA . 27437 1 149 . ASN . 27437 1 150 . LYS . 27437 1 151 . GLU . 27437 1 152 . LEU . 27437 1 153 . THR . 27437 1 154 . PHE . 27437 1 155 . LEU . 27437 1 156 . LEU . 27437 1 157 . PHE . 27437 1 158 . SER . 27437 1 159 . CYS . 27437 1 160 . PRO . 27437 1 161 . HIS . 27437 1 162 . ARG . 27437 1 163 . LEU . 27437 1 164 . ARG . 27437 1 165 . GLU . 27437 1 166 . HIS . 27437 1 167 . LEU . 27437 1 168 . GLU . 27437 1 169 . ARG . 27437 1 170 . GLY . 27437 1 171 . ARG . 27437 1 172 . GLY . 27437 1 173 . ASN . 27437 1 174 . LEU . 27437 1 175 . GLU . 27437 1 176 . TRP . 27437 1 177 . LYS . 27437 1 178 . GLU . 27437 1 179 . PRO . 27437 1 180 . PRO . 27437 1 181 . SER . 27437 1 182 . MET . 27437 1 183 . ARG . 27437 1 184 . LEU . 27437 1 185 . LYS . 27437 1 186 . ALA . 27437 1 187 . ARG . 27437 1 188 . PRO . 27437 1 189 . SER . 27437 1 190 . SER . 27437 1 191 . PRO . 27437 1 192 . GLY . 27437 1 193 . PHE . 27437 1 194 . SER . 27437 1 195 . VAL . 27437 1 196 . LEU . 27437 1 197 . THR . 27437 1 198 . CYS . 27437 1 199 . SER . 27437 1 200 . ALA . 27437 1 201 . PHE . 27437 1 202 . SER . 27437 1 203 . PHE . 27437 1 204 . TYR . 27437 1 205 . PRO . 27437 1 206 . PRO . 27437 1 207 . GLU . 27437 1 208 . LEU . 27437 1 209 . GLN . 27437 1 210 . LEU . 27437 1 211 . ARG . 27437 1 212 . PHE . 27437 1 213 . LEU . 27437 1 214 . ARG . 27437 1 215 . ASN . 27437 1 216 . GLY . 27437 1 217 . LEU . 27437 1 218 . ALA . 27437 1 219 . ALA . 27437 1 220 . GLY . 27437 1 221 . THR . 27437 1 222 . GLY . 27437 1 223 . GLN . 27437 1 224 . GLY . 27437 1 225 . ASP . 27437 1 226 . PHE . 27437 1 227 . GLY . 27437 1 228 . PRO . 27437 1 229 . ASN . 27437 1 230 . SER . 27437 1 231 . ASP . 27437 1 232 . GLY . 27437 1 233 . SER . 27437 1 234 . PHE . 27437 1 235 . HIS . 27437 1 236 . ALA . 27437 1 237 . SER . 27437 1 238 . SER . 27437 1 239 . SER . 27437 1 240 . LEU . 27437 1 241 . THR . 27437 1 242 . VAL . 27437 1 243 . LYS . 27437 1 244 . SER . 27437 1 245 . GLY . 27437 1 246 . ASP . 27437 1 247 . GLU . 27437 1 248 . HIS . 27437 1 249 . HIS . 27437 1 250 . TYR . 27437 1 251 . CYS . 27437 1 252 . CYS . 27437 1 253 . ILE . 27437 1 254 . VAL . 27437 1 255 . GLN . 27437 1 256 . HIS . 27437 1 257 . ALA . 27437 1 258 . GLY . 27437 1 259 . LEU . 27437 1 260 . ALA . 27437 1 261 . GLN . 27437 1 262 . PRO . 27437 1 263 . LEU . 27437 1 264 . ARG . 27437 1 265 . VAL . 27437 1 266 . GLU . 27437 1 267 . LEU . 27437 1 268 . GLU . 27437 1 269 . SER . 27437 1 270 . PRO . 27437 1 271 . ALA . 27437 1 272 . LYS . 27437 1 273 . SER . 27437 1 274 . SER . 27437 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 . ALA 1 1 27437 1 . GLU 2 2 27437 1 . SER 3 3 27437 1 . HIS 4 4 27437 1 . LEU 5 5 27437 1 . SER 6 6 27437 1 . LEU 7 7 27437 1 . LEU 8 8 27437 1 . TYR 9 9 27437 1 . HIS 10 10 27437 1 . LEU 11 11 27437 1 . THR 12 12 27437 1 . ALA 13 13 27437 1 . VAL 14 14 27437 1 . SER 15 15 27437 1 . SER 16 16 27437 1 . PRO 17 17 27437 1 . ALA 18 18 27437 1 . PRO 19 19 27437 1 . GLY 20 20 27437 1 . THR 21 21 27437 1 . PRO 22 22 27437 1 . ALA 23 23 27437 1 . PHE 24 24 27437 1 . TRP 25 25 27437 1 . VAL 26 26 27437 1 . SER 27 27 27437 1 . GLY 28 28 27437 1 . TRP 29 29 27437 1 . LEU 30 30 27437 1 . GLY 31 31 27437 1 . PRO 32 32 27437 1 . GLN 33 33 27437 1 . GLN 34 34 27437 1 . TYR 35 35 27437 1 . LEU 36 36 27437 1 . SER 37 37 27437 1 . TYR 38 38 27437 1 . ASN 39 39 27437 1 . SER 40 40 27437 1 . LEU 41 41 27437 1 . ARG 42 42 27437 1 . GLY 43 43 27437 1 . GLU 44 44 27437 1 . ALA 45 45 27437 1 . GLU 46 46 27437 1 . PRO 47 47 27437 1 . CYS 48 48 27437 1 . GLY 49 49 27437 1 . ALA 50 50 27437 1 . TRP 51 51 27437 1 . VAL 52 52 27437 1 . TRP 53 53 27437 1 . GLU 54 54 27437 1 . ASN 55 55 27437 1 . GLN 56 56 27437 1 . VAL 57 57 27437 1 . SER 58 58 27437 1 . TRP 59 59 27437 1 . TYR 60 60 27437 1 . TRP 61 61 27437 1 . GLU 62 62 27437 1 . LYS 63 63 27437 1 . GLU 64 64 27437 1 . THR 65 65 27437 1 . THR 66 66 27437 1 . ASP 67 67 27437 1 . LEU 68 68 27437 1 . ARG 69 69 27437 1 . ILE 70 70 27437 1 . LYS 71 71 27437 1 . GLU 72 72 27437 1 . LYS 73 73 27437 1 . LEU 74 74 27437 1 . PHE 75 75 27437 1 . LEU 76 76 27437 1 . GLU 77 77 27437 1 . ALA 78 78 27437 1 . PHE 79 79 27437 1 . LYS 80 80 27437 1 . ALA 81 81 27437 1 . LEU 82 82 27437 1 . GLY 83 83 27437 1 . GLY 84 84 27437 1 . LYS 85 85 27437 1 . GLY 86 86 27437 1 . PRO 87 87 27437 1 . TYR 88 88 27437 1 . THR 89 89 27437 1 . LEU 90 90 27437 1 . GLN 91 91 27437 1 . GLY 92 92 27437 1 . LEU 93 93 27437 1 . LEU 94 94 27437 1 . GLY 95 95 27437 1 . CYS 96 96 27437 1 . GLU 97 97 27437 1 . LEU 98 98 27437 1 . GLY 99 99 27437 1 . PRO 100 100 27437 1 . ASP 101 101 27437 1 . ASN 102 102 27437 1 . THR 103 103 27437 1 . SER 104 104 27437 1 . VAL 105 105 27437 1 . PRO 106 106 27437 1 . THR 107 107 27437 1 . ALA 108 108 27437 1 . LYS 109 109 27437 1 . PHE 110 110 27437 1 . ALA 111 111 27437 1 . LEU 112 112 27437 1 . ASN 113 113 27437 1 . GLY 114 114 27437 1 . GLU 115 115 27437 1 . GLU 116 116 27437 1 . PHE 117 117 27437 1 . MET 118 118 27437 1 . ASN 119 119 27437 1 . PHE 120 120 27437 1 . ASP 121 121 27437 1 . LEU 122 122 27437 1 . LYS 123 123 27437 1 . GLN 124 124 27437 1 . GLY 125 125 27437 1 . THR 126 126 27437 1 . TRP 127 127 27437 1 . GLY 128 128 27437 1 . GLY 129 129 27437 1 . ASP 130 130 27437 1 . TRP 131 131 27437 1 . PRO 132 132 27437 1 . GLU 133 133 27437 1 . ALA 134 134 27437 1 . LEU 135 135 27437 1 . ALA 136 136 27437 1 . ILE 137 137 27437 1 . SER 138 138 27437 1 . GLN 139 139 27437 1 . ARG 140 140 27437 1 . TRP 141 141 27437 1 . GLN 142 142 27437 1 . GLN 143 143 27437 1 . GLN 144 144 27437 1 . ASP 145 145 27437 1 . LYS 146 146 27437 1 . ALA 147 147 27437 1 . ALA 148 148 27437 1 . ASN 149 149 27437 1 . LYS 150 150 27437 1 . GLU 151 151 27437 1 . LEU 152 152 27437 1 . THR 153 153 27437 1 . PHE 154 154 27437 1 . LEU 155 155 27437 1 . LEU 156 156 27437 1 . PHE 157 157 27437 1 . SER 158 158 27437 1 . CYS 159 159 27437 1 . PRO 160 160 27437 1 . HIS 161 161 27437 1 . ARG 162 162 27437 1 . LEU 163 163 27437 1 . ARG 164 164 27437 1 . GLU 165 165 27437 1 . HIS 166 166 27437 1 . LEU 167 167 27437 1 . GLU 168 168 27437 1 . ARG 169 169 27437 1 . GLY 170 170 27437 1 . ARG 171 171 27437 1 . GLY 172 172 27437 1 . ASN 173 173 27437 1 . LEU 174 174 27437 1 . GLU 175 175 27437 1 . TRP 176 176 27437 1 . LYS 177 177 27437 1 . GLU 178 178 27437 1 . PRO 179 179 27437 1 . PRO 180 180 27437 1 . SER 181 181 27437 1 . MET 182 182 27437 1 . ARG 183 183 27437 1 . LEU 184 184 27437 1 . LYS 185 185 27437 1 . ALA 186 186 27437 1 . ARG 187 187 27437 1 . PRO 188 188 27437 1 . SER 189 189 27437 1 . SER 190 190 27437 1 . PRO 191 191 27437 1 . GLY 192 192 27437 1 . PHE 193 193 27437 1 . SER 194 194 27437 1 . VAL 195 195 27437 1 . LEU 196 196 27437 1 . THR 197 197 27437 1 . CYS 198 198 27437 1 . SER 199 199 27437 1 . ALA 200 200 27437 1 . PHE 201 201 27437 1 . SER 202 202 27437 1 . PHE 203 203 27437 1 . TYR 204 204 27437 1 . PRO 205 205 27437 1 . PRO 206 206 27437 1 . GLU 207 207 27437 1 . LEU 208 208 27437 1 . GLN 209 209 27437 1 . LEU 210 210 27437 1 . ARG 211 211 27437 1 . PHE 212 212 27437 1 . LEU 213 213 27437 1 . ARG 214 214 27437 1 . ASN 215 215 27437 1 . GLY 216 216 27437 1 . LEU 217 217 27437 1 . ALA 218 218 27437 1 . ALA 219 219 27437 1 . GLY 220 220 27437 1 . THR 221 221 27437 1 . GLY 222 222 27437 1 . GLN 223 223 27437 1 . GLY 224 224 27437 1 . ASP 225 225 27437 1 . PHE 226 226 27437 1 . GLY 227 227 27437 1 . PRO 228 228 27437 1 . ASN 229 229 27437 1 . SER 230 230 27437 1 . ASP 231 231 27437 1 . GLY 232 232 27437 1 . SER 233 233 27437 1 . PHE 234 234 27437 1 . HIS 235 235 27437 1 . ALA 236 236 27437 1 . SER 237 237 27437 1 . SER 238 238 27437 1 . SER 239 239 27437 1 . LEU 240 240 27437 1 . THR 241 241 27437 1 . VAL 242 242 27437 1 . LYS 243 243 27437 1 . SER 244 244 27437 1 . GLY 245 245 27437 1 . ASP 246 246 27437 1 . GLU 247 247 27437 1 . HIS 248 248 27437 1 . HIS 249 249 27437 1 . TYR 250 250 27437 1 . CYS 251 251 27437 1 . CYS 252 252 27437 1 . ILE 253 253 27437 1 . VAL 254 254 27437 1 . GLN 255 255 27437 1 . HIS 256 256 27437 1 . ALA 257 257 27437 1 . GLY 258 258 27437 1 . LEU 259 259 27437 1 . ALA 260 260 27437 1 . GLN 261 261 27437 1 . PRO 262 262 27437 1 . LEU 263 263 27437 1 . ARG 264 264 27437 1 . VAL 265 265 27437 1 . GLU 266 266 27437 1 . LEU 267 267 27437 1 . GLU 268 268 27437 1 . SER 269 269 27437 1 . PRO 270 270 27437 1 . ALA 271 271 27437 1 . LYS 272 272 27437 1 . SER 273 273 27437 1 . SER 274 274 27437 1 stop_ save_ save_b2-microglobulin _Entity.Sf_category entity _Entity.Sf_framecode b2-microglobulin _Entity.Entry_ID 27437 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name b2-microglobulin _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; IQRTPKIQVYSRHPAENGKS NFLNCYVSGFHPSDIEVDLL KNGERIEKVEHSDLSFSKDW SFYLLYYTEFTPTEKDEYAC RVNHVTLSQPKIVKWDRDM ; _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 99 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all disulfide bound' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . 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 . ILE . 27437 2 2 . GLN . 27437 2 3 . ARG . 27437 2 4 . THR . 27437 2 5 . PRO . 27437 2 6 . LYS . 27437 2 7 . ILE . 27437 2 8 . GLN . 27437 2 9 . VAL . 27437 2 10 . TYR . 27437 2 11 . SER . 27437 2 12 . ARG . 27437 2 13 . HIS . 27437 2 14 . PRO . 27437 2 15 . ALA . 27437 2 16 . GLU . 27437 2 17 . ASN . 27437 2 18 . GLY . 27437 2 19 . LYS . 27437 2 20 . SER . 27437 2 21 . ASN . 27437 2 22 . PHE . 27437 2 23 . LEU . 27437 2 24 . ASN . 27437 2 25 . CYS . 27437 2 26 . TYR . 27437 2 27 . VAL . 27437 2 28 . SER . 27437 2 29 . GLY . 27437 2 30 . PHE . 27437 2 31 . HIS . 27437 2 32 . PRO . 27437 2 33 . SER . 27437 2 34 . ASP . 27437 2 35 . ILE . 27437 2 36 . GLU . 27437 2 37 . VAL . 27437 2 38 . ASP . 27437 2 39 . LEU . 27437 2 40 . LEU . 27437 2 41 . LYS . 27437 2 42 . ASN . 27437 2 43 . GLY . 27437 2 44 . GLU . 27437 2 45 . ARG . 27437 2 46 . ILE . 27437 2 47 . GLU . 27437 2 48 . LYS . 27437 2 49 . VAL . 27437 2 50 . GLU . 27437 2 51 . HIS . 27437 2 52 . SER . 27437 2 53 . ASP . 27437 2 54 . LEU . 27437 2 55 . SER . 27437 2 56 . PHE . 27437 2 57 . SER . 27437 2 58 . LYS . 27437 2 59 . ASP . 27437 2 60 . TRP . 27437 2 61 . SER . 27437 2 62 . PHE . 27437 2 63 . TYR . 27437 2 64 . LEU . 27437 2 65 . LEU . 27437 2 66 . TYR . 27437 2 67 . TYR . 27437 2 68 . THR . 27437 2 69 . GLU . 27437 2 70 . PHE . 27437 2 71 . THR . 27437 2 72 . PRO . 27437 2 73 . THR . 27437 2 74 . GLU . 27437 2 75 . LYS . 27437 2 76 . ASP . 27437 2 77 . GLU . 27437 2 78 . TYR . 27437 2 79 . ALA . 27437 2 80 . CYS . 27437 2 81 . ARG . 27437 2 82 . VAL . 27437 2 83 . ASN . 27437 2 84 . HIS . 27437 2 85 . VAL . 27437 2 86 . THR . 27437 2 87 . LEU . 27437 2 88 . SER . 27437 2 89 . GLN . 27437 2 90 . PRO . 27437 2 91 . LYS . 27437 2 92 . ILE . 27437 2 93 . VAL . 27437 2 94 . LYS . 27437 2 95 . TRP . 27437 2 96 . ASP . 27437 2 97 . ARG . 27437 2 98 . ASP . 27437 2 99 . MET . 27437 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 . ILE 1 1 27437 2 . GLN 2 2 27437 2 . ARG 3 3 27437 2 . THR 4 4 27437 2 . PRO 5 5 27437 2 . LYS 6 6 27437 2 . ILE 7 7 27437 2 . GLN 8 8 27437 2 . VAL 9 9 27437 2 . TYR 10 10 27437 2 . SER 11 11 27437 2 . ARG 12 12 27437 2 . HIS 13 13 27437 2 . PRO 14 14 27437 2 . ALA 15 15 27437 2 . GLU 16 16 27437 2 . ASN 17 17 27437 2 . GLY 18 18 27437 2 . LYS 19 19 27437 2 . SER 20 20 27437 2 . ASN 21 21 27437 2 . PHE 22 22 27437 2 . LEU 23 23 27437 2 . ASN 24 24 27437 2 . CYS 25 25 27437 2 . TYR 26 26 27437 2 . VAL 27 27 27437 2 . SER 28 28 27437 2 . GLY 29 29 27437 2 . PHE 30 30 27437 2 . HIS 31 31 27437 2 . PRO 32 32 27437 2 . SER 33 33 27437 2 . ASP 34 34 27437 2 . ILE 35 35 27437 2 . GLU 36 36 27437 2 . VAL 37 37 27437 2 . ASP 38 38 27437 2 . LEU 39 39 27437 2 . LEU 40 40 27437 2 . LYS 41 41 27437 2 . ASN 42 42 27437 2 . GLY 43 43 27437 2 . GLU 44 44 27437 2 . ARG 45 45 27437 2 . ILE 46 46 27437 2 . GLU 47 47 27437 2 . LYS 48 48 27437 2 . VAL 49 49 27437 2 . GLU 50 50 27437 2 . HIS 51 51 27437 2 . SER 52 52 27437 2 . ASP 53 53 27437 2 . LEU 54 54 27437 2 . SER 55 55 27437 2 . PHE 56 56 27437 2 . SER 57 57 27437 2 . LYS 58 58 27437 2 . ASP 59 59 27437 2 . TRP 60 60 27437 2 . SER 61 61 27437 2 . PHE 62 62 27437 2 . TYR 63 63 27437 2 . LEU 64 64 27437 2 . LEU 65 65 27437 2 . TYR 66 66 27437 2 . TYR 67 67 27437 2 . THR 68 68 27437 2 . GLU 69 69 27437 2 . PHE 70 70 27437 2 . THR 71 71 27437 2 . PRO 72 72 27437 2 . THR 73 73 27437 2 . GLU 74 74 27437 2 . LYS 75 75 27437 2 . ASP 76 76 27437 2 . GLU 77 77 27437 2 . TYR 78 78 27437 2 . ALA 79 79 27437 2 . CYS 80 80 27437 2 . ARG 81 81 27437 2 . VAL 82 82 27437 2 . ASN 83 83 27437 2 . HIS 84 84 27437 2 . VAL 85 85 27437 2 . THR 86 86 27437 2 . LEU 87 87 27437 2 . SER 88 88 27437 2 . GLN 89 89 27437 2 . PRO 90 90 27437 2 . LYS 91 91 27437 2 . ILE 92 92 27437 2 . VAL 93 93 27437 2 . LYS 94 94 27437 2 . TRP 95 95 27437 2 . ASP 96 96 27437 2 . ARG 97 97 27437 2 . ASP 98 98 27437 2 . MET 99 99 27437 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 27437 _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.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.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $a-chain . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . 27437 1 2 2 $b2-microglobulin . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . 27437 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 27437 _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_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.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $a-chain . 'recombinant technology' 'Mammalian HEK293 cells' . . . . . . . . . . . pMFcRnECD-B2M-Neo . . . 27437 1 2 2 $b2-microglobulin . 'recombinant technology' 'Mammalian HEK293 cells' . . . . . . . . . . . pMFcRnECD-B2M-Neo . . . 27437 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 27437 _Sample.ID 1 _Sample.Type 'gel solid' _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% H2O' _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 a-chain '[U-100% 13C; U-100% 15N]' . . 2 $b2-microglobulin . . 550 100 1000 uM . . . . 27437 1 2 b2-microglobulin '[U-100% 13C; U-100% 15N]' . . 1 $a-chain . . 550 100 1000 uM . . . . 27437 1 3 NaCl 'natural abundance' . . . . . . 100 . . mM . . . . 27437 1 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 27437 _Sample_condition_list.ID 1 _Sample_condition_list.Details . 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' 100 . mM 27437 1 pH 7.4 . pH 27437 1 pressure 1 . atm 27437 1 temperature 283 . K 27437 1 stop_ save_ ############################ # Computer software used # ############################ save_CCPN _Software.Sf_category software _Software.Sf_framecode CCPN _Software.Entry_ID 27437 _Software.ID 1 _Software.Type . _Software.Name CCPN _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID CCPN . . 27437 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 27437 1 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 27437 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 850 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 27437 _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 Avance . 850 . . . 27437 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 27437 _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 . . . . . . . . . . . . . . . . 27437 1 2 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27437 1 3 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27437 1 4 '3D HN(CO)CA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27437 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 27437 _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.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . 27437 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 27437 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . 27437 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_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 27437 _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 1 '2D 1H-15N HSQC' . . . 27437 1 2 '3D HNCA' . . . 27437 1 3 '3D HNCACB' . . . 27437 1 4 '3D HN(CO)CA' . . . 27437 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.Ambiguity_set_ID _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 3 3 ARG H H 1 9.56 . . 1 . . . . . 3 ARG H . 27437 1 2 . 2 2 3 3 ARG CA C 13 55.14 . . 1 . . . . . 3 ARG CA . 27437 1 3 . 2 2 3 3 ARG CB C 13 34.45 . . 1 . . . . . 3 ARG CB . 27437 1 4 . 2 2 3 3 ARG N N 15 122.24 . . 1 . . . . . 3 ARG N . 27437 1 5 . 2 2 5 5 PRO CA C 13 62.56 . . 1 . . . . . 5 PRO CA . 27437 1 6 . 2 2 6 6 LYS H H 1 9.38 . . 1 . . . . . 6 LYS H . 27437 1 7 . 2 2 6 6 LYS CA C 13 55.82 . . 1 . . . . . 6 LYS CA . 27437 1 8 . 2 2 6 6 LYS CB C 13 33.30 . . 1 . . . . . 6 LYS CB . 27437 1 9 . 2 2 6 6 LYS N N 15 124.58 . . 1 . . . . . 6 LYS N . 27437 1 10 . 2 2 7 7 ILE H H 1 8.51 . . 1 . . . . . 7 ILE H . 27437 1 11 . 2 2 7 7 ILE CA C 13 61.47 . . 1 . . . . . 7 ILE CA . 27437 1 12 . 2 2 7 7 ILE N N 15 124.54 . . 1 . . . . . 7 ILE N . 27437 1 13 . 2 2 11 11 SER H H 1 9.49 . . 1 . . . . . 11 SER H . 27437 1 14 . 2 2 11 11 SER CA C 13 56.68 . . 1 . . . . . 11 SER CA . 27437 1 15 . 2 2 11 11 SER CB C 13 66.72 . . 1 . . . . . 11 SER CB . 27437 1 16 . 2 2 11 11 SER N N 15 117.98 . . 1 . . . . . 11 SER N . 27437 1 17 . 2 2 12 12 ARG H H 1 8.93 . . 1 . . . . . 12 ARG H . 27437 1 18 . 2 2 12 12 ARG CA C 13 60.60 . . 1 . . . . . 12 ARG CA . 27437 1 19 . 2 2 12 12 ARG CB C 13 34.35 . . 1 . . . . . 12 ARG CB . 27437 1 20 . 2 2 12 12 ARG N N 15 122.56 . . 1 . . . . . 12 ARG N . 27437 1 21 . 2 2 13 13 HIS H H 1 8.24 . . 1 . . . . . 13 HIS H . 27437 1 22 . 2 2 13 13 HIS CA C 13 51.36 . . 1 . . . . . 13 HIS CA . 27437 1 23 . 2 2 13 13 HIS N N 15 113.63 . . 1 . . . . . 13 HIS N . 27437 1 24 . 2 2 15 15 ALA H H 1 9.20 . . 1 . . . . . 15 ALA H . 27437 1 25 . 2 2 15 15 ALA CA C 13 53.57 . . 1 . . . . . 15 ALA CA . 27437 1 26 . 2 2 15 15 ALA CB C 13 19.57 . . 1 . . . . . 15 ALA CB . 27437 1 27 . 2 2 15 15 ALA N N 15 127.28 . . 1 . . . . . 15 ALA N . 27437 1 28 . 2 2 16 16 GLU H H 1 9.02 . . 1 . . . . . 16 GLU H . 27437 1 29 . 2 2 16 16 GLU CA C 13 54.74 . . 1 . . . . . 16 GLU CA . 27437 1 30 . 2 2 16 16 GLU CB C 13 32.44 . . 1 . . . . . 16 GLU CB . 27437 1 31 . 2 2 16 16 GLU N N 15 125.30 . . 1 . . . . . 16 GLU N . 27437 1 32 . 2 2 17 17 ASN H H 1 8.86 . . 1 . . . . . 17 ASN H . 27437 1 33 . 2 2 17 17 ASN CA C 13 54.37 . . 1 . . . . . 17 ASN CA . 27437 1 34 . 2 2 17 17 ASN CB C 13 37.07 . . 1 . . . . . 17 ASN CB . 27437 1 35 . 2 2 17 17 ASN N N 15 123.30 . . 1 . . . . . 17 ASN N . 27437 1 36 . 2 2 18 18 GLY H H 1 8.82 . . 1 . . . . . 18 GLY H . 27437 1 37 . 2 2 18 18 GLY CA C 13 45.48 . . 1 . . . . . 18 GLY CA . 27437 1 38 . 2 2 18 18 GLY N N 15 109.15 . . 1 . . . . . 18 GLY N . 27437 1 39 . 2 2 19 19 LYS H H 1 7.96 . . 1 . . . . . 19 LYS H . 27437 1 40 . 2 2 19 19 LYS CA C 13 54.09 . . 1 . . . . . 19 LYS CA . 27437 1 41 . 2 2 19 19 LYS CB C 13 33.54 . . 1 . . . . . 19 LYS CB . 27437 1 42 . 2 2 19 19 LYS N N 15 121.44 . . 1 . . . . . 19 LYS N . 27437 1 43 . 2 2 20 20 SER H H 1 8.53 . . 1 . . . . . 20 SER H . 27437 1 44 . 2 2 20 20 SER CA C 13 59.51 . . 1 . . . . . 20 SER CA . 27437 1 45 . 2 2 20 20 SER CB C 13 63.14 . . 1 . . . . . 20 SER CB . 27437 1 46 . 2 2 20 20 SER N N 15 120.56 . . 1 . . . . . 20 SER N . 27437 1 47 . 2 2 21 21 ASN H H 1 8.97 . . 1 . . . . . 21 ASN H . 27437 1 48 . 2 2 21 21 ASN CA C 13 50.68 . . 1 . . . . . 21 ASN CA . 27437 1 49 . 2 2 21 21 ASN CB C 13 42.14 . . 1 . . . . . 21 ASN CB . 27437 1 50 . 2 2 21 21 ASN N N 15 127.05 . . 1 . . . . . 21 ASN N . 27437 1 51 . 2 2 22 22 PHE H H 1 10.45 . . 1 . . . . . 22 PHE H . 27437 1 52 . 2 2 22 22 PHE CA C 13 57.62 . . 1 . . . . . 22 PHE CA . 27437 1 53 . 2 2 22 22 PHE CB C 13 43.93 . . 1 . . . . . 22 PHE CB . 27437 1 54 . 2 2 22 22 PHE N N 15 119.97 . . 1 . . . . . 22 PHE N . 27437 1 55 . 2 2 23 23 LEU H H 1 8.98 . . 1 . . . . . 23 LEU H . 27437 1 56 . 2 2 23 23 LEU CA C 13 53.26 . . 1 . . . . . 23 LEU CA . 27437 1 57 . 2 2 23 23 LEU CB C 13 41.66 . . 1 . . . . . 23 LEU CB . 27437 1 58 . 2 2 23 23 LEU N N 15 125.95 . . 1 . . . . . 23 LEU N . 27437 1 59 . 2 2 24 24 ASN H H 1 8.26 . . 1 . . . . . 24 ASN H . 27437 1 60 . 2 2 24 24 ASN CA C 13 51.29 . . 1 . . . . . 24 ASN CA . 27437 1 61 . 2 2 24 24 ASN CB C 13 41.37 . . 1 . . . . . 24 ASN CB . 27437 1 62 . 2 2 24 24 ASN N N 15 121.45 . . 1 . . . . . 24 ASN N . 27437 1 63 . 2 2 25 25 CYS H H 1 9.68 . . 1 . . . . . 25 CYS H . 27437 1 64 . 2 2 25 25 CYS CA C 13 53.76 . . 1 . . . . . 25 CYS CA . 27437 1 65 . 2 2 25 25 CYS CB C 13 41.69 . . 1 . . . . . 25 CYS CB . 27437 1 66 . 2 2 25 25 CYS N N 15 120.46 . . 1 . . . . . 25 CYS N . 27437 1 67 . 2 2 26 26 TYR H H 1 9.59 . . 1 . . . . . 26 TYR H . 27437 1 68 . 2 2 26 26 TYR CA C 13 55.16 . . 1 . . . . . 26 TYR CA . 27437 1 69 . 2 2 26 26 TYR CB C 13 41.09 . . 1 . . . . . 26 TYR CB . 27437 1 70 . 2 2 26 26 TYR N N 15 129.31 . . 1 . . . . . 26 TYR N . 27437 1 71 . 2 2 27 27 VAL H H 1 8.93 . . 1 . . . . . 27 VAL H . 27437 1 72 . 2 2 27 27 VAL CA C 13 59.74 . . 1 . . . . . 27 VAL CA . 27437 1 73 . 2 2 27 27 VAL CB C 13 33.18 . . 1 . . . . . 27 VAL CB . 27437 1 74 . 2 2 27 27 VAL N N 15 130.58 . . 1 . . . . . 27 VAL N . 27437 1 75 . 2 2 28 28 SER H H 1 9.13 . . 1 . . . . . 28 SER H . 27437 1 76 . 2 2 28 28 SER CA C 13 57.36 . . 1 . . . . . 28 SER CA . 27437 1 77 . 2 2 28 28 SER CB C 13 67.70 . . 1 . . . . . 28 SER CB . 27437 1 78 . 2 2 28 28 SER N N 15 118.43 . . 1 . . . . . 28 SER N . 27437 1 79 . 2 2 29 29 GLY H H 1 8.32 . . 1 . . . . . 29 GLY H . 27437 1 80 . 2 2 29 29 GLY CA C 13 46.25 . . 1 . . . . . 29 GLY CA . 27437 1 81 . 2 2 29 29 GLY N N 15 108.09 . . 1 . . . . . 29 GLY N . 27437 1 82 . 2 2 33 33 SER CA C 13 61.83 . . 1 . . . . . 33 SER CA . 27437 1 83 . 2 2 34 34 ASP H H 1 7.45 . . 1 . . . . . 34 ASP H . 27437 1 84 . 2 2 34 34 ASP CA C 13 54.91 . . 1 . . . . . 34 ASP CA . 27437 1 85 . 2 2 34 34 ASP CB C 13 40.57 . . 1 . . . . . 34 ASP CB . 27437 1 86 . 2 2 34 34 ASP N N 15 119.89 . . 1 . . . . . 34 ASP N . 27437 1 87 . 2 2 35 35 ILE H H 1 8.08 . . 1 . . . . . 35 ILE H . 27437 1 88 . 2 2 35 35 ILE CA C 13 60.64 . . 1 . . . . . 35 ILE CA . 27437 1 89 . 2 2 35 35 ILE CB C 13 41.24 . . 1 . . . . . 35 ILE CB . 27437 1 90 . 2 2 35 35 ILE N N 15 124.40 . . 1 . . . . . 35 ILE N . 27437 1 91 . 2 2 36 36 GLU H H 1 8.07 . . 1 . . . . . 36 GLU H . 27437 1 92 . 2 2 36 36 GLU CA C 13 54.97 . . 1 . . . . . 36 GLU CA . 27437 1 93 . 2 2 36 36 GLU CB C 13 32.39 . . 1 . . . . . 36 GLU CB . 27437 1 94 . 2 2 36 36 GLU N N 15 126.15 . . 1 . . . . . 36 GLU N . 27437 1 95 . 2 2 38 38 ASP H H 1 8.90 . . 1 . . . . . 38 ASP H . 27437 1 96 . 2 2 38 38 ASP CA C 13 52.57 . . 1 . . . . . 38 ASP CA . 27437 1 97 . 2 2 38 38 ASP CB C 13 46.09 . . 1 . . . . . 38 ASP CB . 27437 1 98 . 2 2 38 38 ASP N N 15 122.40 . . 1 . . . . . 38 ASP N . 27437 1 99 . 2 2 39 39 LEU H H 1 9.25 . . 1 . . . . . 39 LEU H . 27437 1 100 . 2 2 39 39 LEU CA C 13 53.77 . . 1 . . . . . 39 LEU CA . 27437 1 101 . 2 2 39 39 LEU CB C 13 44.07 . . 1 . . . . . 39 LEU CB . 27437 1 102 . 2 2 39 39 LEU N N 15 121.36 . . 1 . . . . . 39 LEU N . 27437 1 103 . 2 2 40 40 LEU H H 1 9.01 . . 1 . . . . . 40 LEU H . 27437 1 104 . 2 2 40 40 LEU CA C 13 52.92 . . 1 . . . . . 40 LEU CA . 27437 1 105 . 2 2 40 40 LEU CB C 13 45.83 . . 1 . . . . . 40 LEU CB . 27437 1 106 . 2 2 40 40 LEU N N 15 120.26 . . 1 . . . . . 40 LEU N . 27437 1 107 . 2 2 41 41 LYS H H 1 8.89 . . 1 . . . . . 41 LYS H . 27437 1 108 . 2 2 41 41 LYS CA C 13 54.13 . . 1 . . . . . 41 LYS CA . 27437 1 109 . 2 2 41 41 LYS CB C 13 34.18 . . 1 . . . . . 41 LYS CB . 27437 1 110 . 2 2 41 41 LYS N N 15 121.02 . . 1 . . . . . 41 LYS N . 27437 1 111 . 2 2 42 42 ASN H H 1 9.85 . . 1 . . . . . 42 ASN H . 27437 1 112 . 2 2 42 42 ASN CA C 13 54.51 . . 1 . . . . . 42 ASN CA . 27437 1 113 . 2 2 42 42 ASN CB C 13 37.26 . . 1 . . . . . 42 ASN CB . 27437 1 114 . 2 2 42 42 ASN N N 15 128.40 . . 1 . . . . . 42 ASN N . 27437 1 115 . 2 2 43 43 GLY H H 1 8.92 . . 1 . . . . . 43 GLY H . 27437 1 116 . 2 2 43 43 GLY CA C 13 45.37 . . 1 . . . . . 43 GLY CA . 27437 1 117 . 2 2 43 43 GLY N N 15 102.37 . . 1 . . . . . 43 GLY N . 27437 1 118 . 2 2 44 44 GLU H H 1 7.86 . . 1 . . . . . 44 GLU H . 27437 1 119 . 2 2 44 44 GLU CA C 13 54.23 . . 1 . . . . . 44 GLU CA . 27437 1 120 . 2 2 44 44 GLU CB C 13 31.77 . . 1 . . . . . 44 GLU CB . 27437 1 121 . 2 2 44 44 GLU N N 15 120.79 . . 1 . . . . . 44 GLU N . 27437 1 122 . 2 2 45 45 ARG H H 1 8.83 . . 1 . . . . . 45 ARG H . 27437 1 123 . 2 2 45 45 ARG CA C 13 57.92 . . 1 . . . . . 45 ARG CA . 27437 1 124 . 2 2 45 45 ARG CB C 13 30.50 . . 1 . . . . . 45 ARG CB . 27437 1 125 . 2 2 45 45 ARG N N 15 124.58 . . 1 . . . . . 45 ARG N . 27437 1 126 . 2 2 46 46 ILE H H 1 8.86 . . 1 . . . . . 46 ILE H . 27437 1 127 . 2 2 46 46 ILE CA C 13 61.90 . . 1 . . . . . 46 ILE CA . 27437 1 128 . 2 2 46 46 ILE N N 15 128.71 . . 1 . . . . . 46 ILE N . 27437 1 129 . 2 2 47 47 GLU H H 1 8.59 . . 1 . . . . . 47 GLU H . 27437 1 130 . 2 2 47 47 GLU CA C 13 58.28 . . 1 . . . . . 47 GLU CA . 27437 1 131 . 2 2 47 47 GLU CB C 13 30.74 . . 1 . . . . . 47 GLU CB . 27437 1 132 . 2 2 47 47 GLU N N 15 126.58 . . 1 . . . . . 47 GLU N . 27437 1 133 . 2 2 48 48 LYS H H 1 8.10 . . 1 . . . . . 48 LYS H . 27437 1 134 . 2 2 48 48 LYS CA C 13 54.96 . . 1 . . . . . 48 LYS CA . 27437 1 135 . 2 2 48 48 LYS N N 15 119.77 . . 1 . . . . . 48 LYS N . 27437 1 136 . 2 2 49 49 VAL H H 1 7.90 . . 1 . . . . . 49 VAL H . 27437 1 137 . 2 2 49 49 VAL CA C 13 55.75 . . 1 . . . . . 49 VAL CA . 27437 1 138 . 2 2 49 49 VAL CB C 13 36.43 . . 1 . . . . . 49 VAL CB . 27437 1 139 . 2 2 49 49 VAL N N 15 122.35 . . 1 . . . . . 49 VAL N . 27437 1 140 . 2 2 50 50 GLU H H 1 8.42 . . 1 . . . . . 50 GLU H . 27437 1 141 . 2 2 50 50 GLU CA C 13 54.17 . . 1 . . . . . 50 GLU CA . 27437 1 142 . 2 2 50 50 GLU CB C 13 33.17 . . 1 . . . . . 50 GLU CB . 27437 1 143 . 2 2 50 50 GLU N N 15 124.54 . . 1 . . . . . 50 GLU N . 27437 1 144 . 2 2 51 51 HIS H H 1 8.08 . . 1 . . . . . 51 HIS H . 27437 1 145 . 2 2 51 51 HIS CA C 13 53.67 . . 1 . . . . . 51 HIS CA . 27437 1 146 . 2 2 51 51 HIS CB C 13 30.36 . . 1 . . . . . 51 HIS CB . 27437 1 147 . 2 2 51 51 HIS N N 15 110.72 . . 1 . . . . . 51 HIS N . 27437 1 148 . 2 2 52 52 SER H H 1 9.22 . . 1 . . . . . 52 SER H . 27437 1 149 . 2 2 52 52 SER CA C 13 57.69 . . 1 . . . . . 52 SER CA . 27437 1 150 . 2 2 52 52 SER CB C 13 66.74 . . 1 . . . . . 52 SER CB . 27437 1 151 . 2 2 52 52 SER N N 15 117.59 . . 1 . . . . . 52 SER N . 27437 1 152 . 2 2 63 63 TYR CA C 13 57.78 . . 1 . . . . . 63 TYR CA . 27437 1 153 . 2 2 64 64 LEU H H 1 9.23 . . 1 . . . . . 64 LEU H . 27437 1 154 . 2 2 64 64 LEU CA C 13 54.88 . . 1 . . . . . 64 LEU CA . 27437 1 155 . 2 2 64 64 LEU N N 15 120.50 . . 1 . . . . . 64 LEU N . 27437 1 156 . 2 2 65 65 LEU CA C 13 55.48 . . 1 . . . . . 65 LEU CA . 27437 1 157 . 2 2 66 66 TYR H H 1 9.17 . . 1 . . . . . 66 TYR H . 27437 1 158 . 2 2 66 66 TYR CA C 13 58.02 . . 1 . . . . . 66 TYR CA . 27437 1 159 . 2 2 66 66 TYR CB C 13 42.14 . . 1 . . . . . 66 TYR CB . 27437 1 160 . 2 2 66 66 TYR N N 15 127.18 . . 1 . . . . . 66 TYR N . 27437 1 161 . 2 2 67 67 TYR H H 1 8.91 . . 1 . . . . . 67 TYR H . 27437 1 162 . 2 2 67 67 TYR CA C 13 55.99 . . 1 . . . . . 67 TYR CA . 27437 1 163 . 2 2 67 67 TYR CB C 13 40.95 . . 1 . . . . . 67 TYR CB . 27437 1 164 . 2 2 67 67 TYR N N 15 116.18 . . 1 . . . . . 67 TYR N . 27437 1 165 . 2 2 68 68 THR H H 1 8.35 . . 1 . . . . . 68 THR H . 27437 1 166 . 2 2 68 68 THR CA C 13 59.96 . . 1 . . . . . 68 THR CA . 27437 1 167 . 2 2 68 68 THR CB C 13 70.33 . . 1 . . . . . 68 THR CB . 27437 1 168 . 2 2 68 68 THR N N 15 111.77 . . 1 . . . . . 68 THR N . 27437 1 169 . 2 2 69 69 GLU H H 1 8.60 . . 1 . . . . . 69 GLU H . 27437 1 170 . 2 2 69 69 GLU CA C 13 56.82 . . 1 . . . . . 69 GLU CA . 27437 1 171 . 2 2 69 69 GLU CB C 13 29.83 . . 1 . . . . . 69 GLU CB . 27437 1 172 . 2 2 69 69 GLU N N 15 130.26 . . 1 . . . . . 69 GLU N . 27437 1 173 . 2 2 70 70 PHE H H 1 8.81 . . 1 . . . . . 70 PHE H . 27437 1 174 . 2 2 70 70 PHE CA C 13 55.32 . . 1 . . . . . 70 PHE CA . 27437 1 175 . 2 2 70 70 PHE CB C 13 41.35 . . 1 . . . . . 70 PHE CB . 27437 1 176 . 2 2 70 70 PHE N N 15 126.02 . . 1 . . . . . 70 PHE N . 27437 1 177 . 2 2 71 71 THR H H 1 8.47 . . 1 . . . . . 71 THR H . 27437 1 178 . 2 2 71 71 THR CA C 13 58.92 . . 1 . . . . . 71 THR CA . 27437 1 179 . 2 2 71 71 THR CB C 13 70.18 . . 1 . . . . . 71 THR CB . 27437 1 180 . 2 2 71 71 THR N N 15 117.52 . . 1 . . . . . 71 THR N . 27437 1 181 . 2 2 72 72 PRO CA C 13 63.15 . . 1 . . . . . 72 PRO CA . 27437 1 182 . 2 2 73 73 THR H H 1 8.03 . . 1 . . . . . 73 THR H . 27437 1 183 . 2 2 73 73 THR CA C 13 60.28 . . 1 . . . . . 73 THR CA . 27437 1 184 . 2 2 73 73 THR CB C 13 73.11 . . 1 . . . . . 73 THR CB . 27437 1 185 . 2 2 73 73 THR N N 15 110.49 . . 1 . . . . . 73 THR N . 27437 1 186 . 2 2 74 74 GLU H H 1 9.14 . . 1 . . . . . 74 GLU H . 27437 1 187 . 2 2 74 74 GLU CA C 13 58.94 . . 1 . . . . . 74 GLU CA . 27437 1 188 . 2 2 74 74 GLU CB C 13 29.86 . . 1 . . . . . 74 GLU CB . 27437 1 189 . 2 2 74 74 GLU N N 15 119.15 . . 1 . . . . . 74 GLU N . 27437 1 190 . 2 2 75 75 LYS H H 1 7.88 . . 1 . . . . . 75 LYS H . 27437 1 191 . 2 2 75 75 LYS CA C 13 56.49 . . 1 . . . . . 75 LYS CA . 27437 1 192 . 2 2 75 75 LYS CB C 13 33.99 . . 1 . . . . . 75 LYS CB . 27437 1 193 . 2 2 75 75 LYS N N 15 113.75 . . 1 . . . . . 75 LYS N . 27437 1 194 . 2 2 76 76 ASP H H 1 7.12 . . 1 . . . . . 76 ASP H . 27437 1 195 . 2 2 76 76 ASP CA C 13 55.37 . . 1 . . . . . 76 ASP CA . 27437 1 196 . 2 2 76 76 ASP CB C 13 43.44 . . 1 . . . . . 76 ASP CB . 27437 1 197 . 2 2 76 76 ASP N N 15 117.95 . . 1 . . . . . 76 ASP N . 27437 1 198 . 2 2 77 77 GLU H H 1 8.64 . . 1 . . . . . 77 GLU H . 27437 1 199 . 2 2 77 77 GLU CA C 13 54.77 . . 1 . . . . . 77 GLU CA . 27437 1 200 . 2 2 77 77 GLU CB C 13 32.70 . . 1 . . . . . 77 GLU CB . 27437 1 201 . 2 2 77 77 GLU N N 15 122.68 . . 1 . . . . . 77 GLU N . 27437 1 202 . 2 2 78 78 TYR H H 1 9.49 . . 1 . . . . . 78 TYR H . 27437 1 203 . 2 2 78 78 TYR CA C 13 56.84 . . 1 . . . . . 78 TYR CA . 27437 1 204 . 2 2 78 78 TYR CB C 13 43.39 . . 1 . . . . . 78 TYR CB . 27437 1 205 . 2 2 78 78 TYR N N 15 123.17 . . 1 . . . . . 78 TYR N . 27437 1 206 . 2 2 79 79 ALA H H 1 8.89 . . 1 . . . . . 79 ALA H . 27437 1 207 . 2 2 79 79 ALA CA C 13 50.97 . . 1 . . . . . 79 ALA CA . 27437 1 208 . 2 2 79 79 ALA CB C 13 23.93 . . 1 . . . . . 79 ALA CB . 27437 1 209 . 2 2 79 79 ALA N N 15 121.40 . . 1 . . . . . 79 ALA N . 27437 1 210 . 2 2 80 80 CYS H H 1 9.18 . . 1 . . . . . 80 CYS H . 27437 1 211 . 2 2 80 80 CYS CA C 13 53.02 . . 1 . . . . . 80 CYS CA . 27437 1 212 . 2 2 80 80 CYS CB C 13 43.46 . . 1 . . . . . 80 CYS CB . 27437 1 213 . 2 2 80 80 CYS N N 15 120.13 . . 1 . . . . . 80 CYS N . 27437 1 214 . 2 2 81 81 ARG H H 1 9.45 . . 1 . . . . . 81 ARG H . 27437 1 215 . 2 2 81 81 ARG CA C 13 53.83 . . 1 . . . . . 81 ARG CA . 27437 1 216 . 2 2 81 81 ARG CB C 13 34.14 . . 1 . . . . . 81 ARG CB . 27437 1 217 . 2 2 81 81 ARG N N 15 128.39 . . 1 . . . . . 81 ARG N . 27437 1 218 . 2 2 82 82 VAL H H 1 9.11 . . 1 . . . . . 82 VAL H . 27437 1 219 . 2 2 82 82 VAL CA C 13 60.27 . . 1 . . . . . 82 VAL CA . 27437 1 220 . 2 2 82 82 VAL CB C 13 36.27 . . 1 . . . . . 82 VAL CB . 27437 1 221 . 2 2 82 82 VAL N N 15 128.30 . . 1 . . . . . 82 VAL N . 27437 1 222 . 2 2 83 83 ASN H H 1 9.09 . . 1 . . . . . 83 ASN H . 27437 1 223 . 2 2 83 83 ASN CA C 13 51.00 . . 1 . . . . . 83 ASN CA . 27437 1 224 . 2 2 83 83 ASN CB C 13 41.69 . . 1 . . . . . 83 ASN CB . 27437 1 225 . 2 2 83 83 ASN N N 15 123.10 . . 1 . . . . . 83 ASN N . 27437 1 226 . 2 2 84 84 HIS H H 1 7.83 . . 1 . . . . . 84 HIS H . 27437 1 227 . 2 2 84 84 HIS CA C 13 56.84 . . 1 . . . . . 84 HIS CA . 27437 1 228 . 2 2 84 84 HIS N N 15 122.40 . . 1 . . . . . 84 HIS N . 27437 1 229 . 2 2 85 85 VAL H H 1 8.23 . . 1 . . . . . 85 VAL H . 27437 1 230 . 2 2 85 85 VAL CA C 13 64.59 . . 1 . . . . . 85 VAL CA . 27437 1 231 . 2 2 85 85 VAL CB C 13 30.99 . . 1 . . . . . 85 VAL CB . 27437 1 232 . 2 2 85 85 VAL N N 15 126.03 . . 1 . . . . . 85 VAL N . 27437 1 233 . 2 2 86 86 THR H H 1 7.52 . . 1 . . . . . 86 THR H . 27437 1 234 . 2 2 86 86 THR CA C 13 63.34 . . 1 . . . . . 86 THR CA . 27437 1 235 . 2 2 86 86 THR CB C 13 69.90 . . 1 . . . . . 86 THR CB . 27437 1 236 . 2 2 86 86 THR N N 15 110.75 . . 1 . . . . . 86 THR N . 27437 1 237 . 2 2 87 87 LEU H H 1 8.02 . . 1 . . . . . 87 LEU H . 27437 1 238 . 2 2 87 87 LEU CA C 13 53.48 . . 1 . . . . . 87 LEU CA . 27437 1 239 . 2 2 87 87 LEU N N 15 123.24 . . 1 . . . . . 87 LEU N . 27437 1 240 . 2 2 91 91 LYS H H 1 8.87 . . 1 . . . . . 91 LYS H . 27437 1 241 . 2 2 91 91 LYS CA C 13 54.67 . . 1 . . . . . 91 LYS CA . 27437 1 242 . 2 2 91 91 LYS CB C 13 35.41 . . 1 . . . . . 91 LYS CB . 27437 1 243 . 2 2 91 91 LYS N N 15 125.22 . . 1 . . . . . 91 LYS N . 27437 1 244 . 2 2 92 92 ILE H H 1 8.59 . . 1 . . . . . 92 ILE H . 27437 1 245 . 2 2 92 92 ILE CA C 13 60.51 . . 1 . . . . . 92 ILE CA . 27437 1 246 . 2 2 92 92 ILE CB C 13 39.25 . . 1 . . . . . 92 ILE CB . 27437 1 247 . 2 2 92 92 ILE N N 15 124.73 . . 1 . . . . . 92 ILE N . 27437 1 248 . 2 2 93 93 VAL H H 1 9.06 . . 1 . . . . . 93 VAL H . 27437 1 249 . 2 2 93 93 VAL CA C 13 61.52 . . 1 . . . . . 93 VAL CA . 27437 1 250 . 2 2 93 93 VAL CB C 13 34.45 . . 1 . . . . . 93 VAL CB . 27437 1 251 . 2 2 93 93 VAL N N 15 129.45 . . 1 . . . . . 93 VAL N . 27437 1 252 . 2 2 94 94 LYS H H 1 8.88 . . 1 . . . . . 94 LYS H . 27437 1 253 . 2 2 94 94 LYS CA C 13 56.47 . . 1 . . . . . 94 LYS CA . 27437 1 254 . 2 2 94 94 LYS CB C 13 33.52 . . 1 . . . . . 94 LYS CB . 27437 1 255 . 2 2 94 94 LYS N N 15 127.70 . . 1 . . . . . 94 LYS N . 27437 1 256 . 2 2 95 95 TRP H H 1 8.79 . . 1 . . . . . 95 TRP H . 27437 1 257 . 2 2 95 95 TRP CA C 13 57.03 . . 1 . . . . . 95 TRP CA . 27437 1 258 . 2 2 95 95 TRP CB C 13 28.49 . . 1 . . . . . 95 TRP CB . 27437 1 259 . 2 2 95 95 TRP N N 15 122.20 . . 1 . . . . . 95 TRP N . 27437 1 260 . 2 2 96 96 ASP H H 1 8.66 . . 1 . . . . . 96 ASP H . 27437 1 261 . 2 2 96 96 ASP CA C 13 52.74 . . 1 . . . . . 96 ASP CA . 27437 1 262 . 2 2 96 96 ASP N N 15 132.16 . . 1 . . . . . 96 ASP N . 27437 1 263 . 2 2 98 98 ASP H H 1 8.31 . . 1 . . . . . 98 ASP H . 27437 1 264 . 2 2 98 98 ASP CA C 13 55.25 . . 1 . . . . . 98 ASP CA . 27437 1 265 . 2 2 98 98 ASP N N 15 121.07 . . 1 . . . . . 98 ASP N . 27437 1 stop_ save_ save_assigned_chem_shift_list_2 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_2 _Assigned_chem_shift_list.Entry_ID 27437 _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 1 '2D 1H-15N HSQC' . . . 27437 2 2 '3D HNCA' . . . 27437 2 3 '3D HNCACB' . . . 27437 2 4 '3D HN(CO)CA' . . . 27437 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.Ambiguity_set_ID _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 32 32 PRO CA C 13 64.16 . . 1 . . . . . 32 PRO CA . 27437 2 2 . 1 1 33 33 GLN H H 1 7.31 . . 1 . . . . . 33 GLN H . 27437 2 3 . 1 1 33 33 GLN CA C 13 58.37 . . 1 . . . . . 33 GLN CA . 27437 2 4 . 1 1 33 33 GLN CB C 13 28.06 . . 1 . . . . . 33 GLN CB . 27437 2 5 . 1 1 33 33 GLN N N 15 117.52 . . 1 . . . . . 33 GLN N . 27437 2 6 . 1 1 34 34 GLN H H 1 7.59 . . 1 . . . . . 34 GLN H . 27437 2 7 . 1 1 34 34 GLN CA C 13 55.91 . . 1 . . . . . 34 GLN CA . 27437 2 8 . 1 1 34 34 GLN CB C 13 30.37 . . 1 . . . . . 34 GLN CB . 27437 2 9 . 1 1 34 34 GLN N N 15 115.00 . . 1 . . . . . 34 GLN N . 27437 2 10 . 1 1 35 35 TYR H H 1 7.33 . . 1 . . . . . 35 TYR H . 27437 2 11 . 1 1 35 35 TYR CA C 13 54.54 . . 1 . . . . . 35 TYR CA . 27437 2 12 . 1 1 35 35 TYR CB C 13 37.55 . . 1 . . . . . 35 TYR CB . 27437 2 13 . 1 1 35 35 TYR N N 15 121.73 . . 1 . . . . . 35 TYR N . 27437 2 14 . 1 1 36 36 LEU H H 1 9.96 . . 1 . . . . . 36 LEU H . 27437 2 15 . 1 1 36 36 LEU CA C 13 56.49 . . 1 . . . . . 36 LEU CA . 27437 2 16 . 1 1 36 36 LEU CB C 13 44.95 . . 1 . . . . . 36 LEU CB . 27437 2 17 . 1 1 36 36 LEU N N 15 127.22 . . 1 . . . . . 36 LEU N . 27437 2 18 . 1 1 37 37 SER H H 1 8.13 . . 1 . . . . . 37 SER H . 27437 2 19 . 1 1 37 37 SER CA C 13 55.36 . . 1 . . . . . 37 SER CA . 27437 2 20 . 1 1 37 37 SER CB C 13 62.56 . . 1 . . . . . 37 SER CB . 27437 2 21 . 1 1 37 37 SER N N 15 119.18 . . 1 . . . . . 37 SER N . 27437 2 22 . 1 1 38 38 TYR H H 1 6.51 . . 1 . . . . . 38 TYR H . 27437 2 23 . 1 1 38 38 TYR CA C 13 58.68 . . 1 . . . . . 38 TYR CA . 27437 2 24 . 1 1 38 38 TYR CB C 13 37.11 . . 1 . . . . . 38 TYR CB . 27437 2 25 . 1 1 38 38 TYR N N 15 111.44 . . 1 . . . . . 38 TYR N . 27437 2 26 . 1 1 39 39 ASN H H 1 7.37 . . 1 . . . . . 39 ASN H . 27437 2 27 . 1 1 39 39 ASN CA C 13 53.30 . . 1 . . . . . 39 ASN CA . 27437 2 28 . 1 1 39 39 ASN CB C 13 39.64 . . 1 . . . . . 39 ASN CB . 27437 2 29 . 1 1 39 39 ASN N N 15 116.41 . . 1 . . . . . 39 ASN N . 27437 2 30 . 1 1 40 40 SER H H 1 9.09 . . 1 . . . . . 40 SER H . 27437 2 31 . 1 1 40 40 SER CA C 13 60.52 . . 1 . . . . . 40 SER CA . 27437 2 32 . 1 1 40 40 SER CB C 13 63.30 . . 1 . . . . . 40 SER CB . 27437 2 33 . 1 1 40 40 SER N N 15 119.41 . . 1 . . . . . 40 SER N . 27437 2 34 . 1 1 41 41 LEU H H 1 8.80 . . 1 . . . . . 41 LEU H . 27437 2 35 . 1 1 41 41 LEU CA C 13 52.64 . . 1 . . . . . 41 LEU CA . 27437 2 36 . 1 1 41 41 LEU CB C 13 46.11 . . 1 . . . . . 41 LEU CB . 27437 2 37 . 1 1 41 41 LEU N N 15 122.35 . . 1 . . . . . 41 LEU N . 27437 2 38 . 1 1 47 47 PRO CA C 13 61.99 . . 1 . . . . . 47 PRO CA . 27437 2 39 . 1 1 48 48 CYS H H 1 9.71 . . 1 . . . . . 48 CYS H . 27437 2 40 . 1 1 48 48 CYS CA C 13 53.17 . . 1 . . . . . 48 CYS CA . 27437 2 41 . 1 1 48 48 CYS CB C 13 42.07 . . 1 . . . . . 48 CYS CB . 27437 2 42 . 1 1 48 48 CYS N N 15 131.78 . . 1 . . . . . 48 CYS N . 27437 2 43 . 1 1 49 49 GLY H H 1 10.28 . . 1 . . . . . 49 GLY H . 27437 2 44 . 1 1 49 49 GLY CA C 13 45.58 . . 1 . . . . . 49 GLY CA . 27437 2 45 . 1 1 49 49 GLY N N 15 107.51 . . 1 . . . . . 49 GLY N . 27437 2 46 . 1 1 50 50 ALA H H 1 7.86 . . 1 . . . . . 50 ALA H . 27437 2 47 . 1 1 50 50 ALA CA C 13 54.20 . . 1 . . . . . 50 ALA CA . 27437 2 48 . 1 1 50 50 ALA CB C 13 20.06 . . 1 . . . . . 50 ALA CB . 27437 2 49 . 1 1 50 50 ALA N N 15 121.24 . . 1 . . . . . 50 ALA N . 27437 2 50 . 1 1 51 51 TRP H H 1 8.18 . . 1 . . . . . 51 TRP H . 27437 2 51 . 1 1 51 51 TRP CA C 13 57.97 . . 1 . . . . . 51 TRP CA . 27437 2 52 . 1 1 51 51 TRP CB C 13 31.97 . . 1 . . . . . 51 TRP CB . 27437 2 53 . 1 1 51 51 TRP N N 15 123.01 . . 1 . . . . . 51 TRP N . 27437 2 54 . 1 1 52 52 VAL H H 1 9.62 . . 1 . . . . . 52 VAL H . 27437 2 55 . 1 1 52 52 VAL CA C 13 60.33 . . 1 . . . . . 52 VAL CA . 27437 2 56 . 1 1 52 52 VAL CB C 13 37.90 . . 1 . . . . . 52 VAL CB . 27437 2 57 . 1 1 52 52 VAL N N 15 119.48 . . 1 . . . . . 52 VAL N . 27437 2 58 . 1 1 53 53 TRP H H 1 7.51 . . 1 . . . . . 53 TRP H . 27437 2 59 . 1 1 53 53 TRP CA C 13 53.12 . . 1 . . . . . 53 TRP CA . 27437 2 60 . 1 1 53 53 TRP CB C 13 29.73 . . 1 . . . . . 53 TRP CB . 27437 2 61 . 1 1 53 53 TRP N N 15 117.27 . . 1 . . . . . 53 TRP N . 27437 2 62 . 1 1 54 54 GLU H H 1 7.87 . . 1 . . . . . 54 GLU H . 27437 2 63 . 1 1 54 54 GLU CA C 13 55.52 . . 1 . . . . . 54 GLU CA . 27437 2 64 . 1 1 54 54 GLU CB C 13 25.88 . . 1 . . . . . 54 GLU CB . 27437 2 65 . 1 1 54 54 GLU N N 15 112.12 . . 1 . . . . . 54 GLU N . 27437 2 66 . 1 1 125 125 GLY CA C 13 45.20 . . 1 . . . . . 125 GLY CA . 27437 2 67 . 1 1 126 126 THR H H 1 8.05 . . 1 . . . . . 126 THR H . 27437 2 68 . 1 1 126 126 THR CA C 13 59.17 . . 1 . . . . . 126 THR CA . 27437 2 69 . 1 1 126 126 THR CB C 13 69.39 . . 1 . . . . . 126 THR CB . 27437 2 70 . 1 1 126 126 THR N N 15 112.03 . . 1 . . . . . 126 THR N . 27437 2 71 . 1 1 228 228 PRO CA C 13 61.44 . . 1 . . . . . 228 PRO CA . 27437 2 72 . 1 1 229 229 ASN H H 1 8.91 . . 1 . . . . . 229 ASN H . 27437 2 73 . 1 1 229 229 ASN CA C 13 55.06 . . 1 . . . . . 229 ASN CA . 27437 2 74 . 1 1 229 229 ASN CB C 13 35.26 . . 1 . . . . . 229 ASN CB . 27437 2 75 . 1 1 229 229 ASN N N 15 126.05 . . 1 . . . . . 229 ASN N . 27437 2 76 . 1 1 230 230 SER H H 1 8.28 . . 1 . . . . . 230 SER H . 27437 2 77 . 1 1 230 230 SER CA C 13 59.52 . . 1 . . . . . 230 SER CA . 27437 2 78 . 1 1 230 230 SER CB C 13 63.61 . . 1 . . . . . 230 SER CB . 27437 2 79 . 1 1 230 230 SER N N 15 117.31 . . 1 . . . . . 230 SER N . 27437 2 80 . 1 1 231 231 ASP H H 1 9.40 . . 1 . . . . . 231 ASP H . 27437 2 81 . 1 1 231 231 ASP CA C 13 57.21 . . 1 . . . . . 231 ASP CA . 27437 2 82 . 1 1 231 231 ASP CB C 13 42.33 . . 1 . . . . . 231 ASP CB . 27437 2 83 . 1 1 231 231 ASP N N 15 127.73 . . 1 . . . . . 231 ASP N . 27437 2 84 . 1 1 232 232 GLY H H 1 8.48 . . 1 . . . . . 232 GLY H . 27437 2 85 . 1 1 232 232 GLY CA C 13 46.22 . . 1 . . . . . 232 GLY CA . 27437 2 86 . 1 1 232 232 GLY N N 15 104.53 . . 1 . . . . . 232 GLY N . 27437 2 stop_ save_