data_4200 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; NMR Solution Structure of the c-Myc-Max Heterodimeric Leucine Zipper ; _BMRB_accession_number 4200 _BMRB_flat_file_name bmr4200.str _Entry_type original _Submission_date 1998-09-10 _Accession_date 1998-09-10 _Entry_origination author _NMR_STAR_version 2.1.1 _Experimental_method NMR _Details . loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Lavigne P. . . 2 Crump M. P. . 3 Gagne S. M. . 4 Hodges R. S. . 5 Kay C. M. . 6 Sykes B. D. . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 2 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 317 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2014-01-09 update BMRB 'Updating non-standard residue' 2008-07-10 update BMRB 'Updating non-standard residue' 2006-09-22 update BMRB 'Updated non-standard residue nomenclature' 2008-03-24 original author . stop_ save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title ; Insights into the Mechanism of Heterodimerization from the 1H-NMR Solution Structure of the c-Myc-Max Heterodimeric Leucine Zipper ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code 98347001 _PubMed_ID ? loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Lavigne P. . . 2 Crump M. P. . 3 Gagne S. M. . 4 Hodges R. S. . 5 Kay C. M. . 6 Sykes B. D. . stop_ _Journal_abbreviation 'J. Mol. Biol.' _Journal_volume 281 _Journal_issue 1 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 165 _Page_last 181 _Year 1998 _Details . loop_ _Keyword '2D NMR' 'buried salt bridge' H-bonds 'Leucine Zippers' 'solution structure' stop_ save_ ####################################### # Cited references within the entry # ####################################### save_reference_one _Saveframe_category citation _Citation_full ; Wishart, D. S., Bigam, C. G., Yao, J., Abildgaard, F., Dyson, H. J., Oldfield, E., Markley, J. L., and Sykes, B. D. J. Biomol. NMR 6, 135-140 (1995). ; _Citation_title . _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID ? loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Wishart D. S. . 2 Bigam C. G. . 3 Yao J. . . 4 Abildgaard F. . . 5 Dyson H. J. . 6 Oldfield E. . . 7 Markley J. L. . 8 Sykes B. D. . stop_ _Journal_abbreviation 'J. Biomol. NMR' _Journal_name_full . _Journal_volume 6 _Journal_issue . _Journal_CSD . _Book_title . _Book_chapter_title . _Book_volume . _Book_series . _Book_publisher . _Book_publisher_city . _Book_ISBN . _Conference_title . _Conference_site . _Conference_state_province . _Conference_country . _Conference_start_date . _Conference_end_date . _Conference_abstract_number . _Thesis_institution . _Thesis_institution_city . _Thesis_institution_country . _Page_first 135 _Page_last 140 _Year 1995 _Details . save_ ################################## # Molecular system description # ################################## save_system_c-Myc-Max_LZ_Leucine_Zipper _Saveframe_category molecular_system _Mol_system_name 'c-Myc-Max Heterodimeric Leucine Zipper' _Abbreviation_common 'c-Myc-Max LZ Leucine Zipper' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'c-Myc LZ Chain A' $c-Myc-Max_Leucine_Zipper_Chain_A 'Max LZ Chain B' $Max_Leucine_Zipper_Chain_B stop_ _System_molecular_weight . _System_physical_state native _System_oligomer_state heterodimer _System_paramagnetic no _System_thiol_state 'not present' loop_ _Biological_function 'transcription factors (b-HLH-LZ)' stop_ _Database_query_date . _Details ; c-Myc LZ, (chain A) Leucine Zipper domain of c-Myc Max LZ, (chain B) Leucine Zipper domain of Max ; save_ ######################## # Monomeric polymers # ######################## save_c-Myc-Max_Leucine_Zipper_Chain_A _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common 'Leucine Zipper domain of c-Myc' _Abbreviation_common 'c-Myc LZ' _Molecular_mass 3846 _Mol_thiol_state 'not present' _Details ; There is a Cys-Gly-Gly linker at the N-terminus for cross-linking to the c-Myc LZ ; ############################## # Polymer residue sequence # ############################## _Residue_count 34 _Mol_residue_sequence ; XCGGVQAEEQKLISEEDLLR KRREQLKHKLEQLX ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 0 ACE 2 1 CYS 3 2 GLY 4 3 GLY 5 4 VAL 6 5 GLN 7 6 ALA 8 7 GLU 9 8 GLU 10 9 GLN 11 10 LYS 12 11 LEU 13 12 ILE 14 13 SER 15 14 GLU 16 15 GLU 17 16 ASP 18 17 LEU 19 18 LEU 20 19 ARG 21 20 LYS 22 21 ARG 23 22 ARG 24 23 GLU 25 24 GLN 26 25 LEU 27 26 LYS 28 27 HIS 29 28 LYS 30 29 LEU 31 30 GLU 32 31 GLN 33 32 LEU 34 33 NH2 stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-08-11 loop_ _Database_name _Database_accession_code _Database_entry_mol_name _Sequence_query_to_submitted_percentage _Sequence_subject_length _Sequence_identity _Sequence_positive _Sequence_homology_expectation_value PDB 1A93 "Nmr Solution Structure Of The C-Myc-Max Heterodimeric Leucine Zipper, Nmr, Minimized Average Structure" 94.12 34 100.00 100.00 5.16e-11 PDB 2A93 "Nmr Solution Structure Of The C-Myc-Max Heterodimeric Leucine Zipper, 40 Structures" 94.12 34 100.00 100.00 5.16e-11 DBJ BAA01374 "p67 myc protein [Homo sapiens]" 85.29 454 100.00 100.00 8.65e-08 DBJ BAA01375 "p64 myc protein [Homo sapiens]" 85.29 439 100.00 100.00 8.27e-08 DBJ BAG35731 "unnamed protein product [Homo sapiens]" 85.29 439 100.00 100.00 8.27e-08 DBJ BAG64849 "unnamed protein product [Homo sapiens]" 85.29 420 100.00 100.00 7.86e-08 DBJ BAI46221 "Myc proto-oncogene protein [synthetic construct]" 85.29 439 100.00 100.00 8.27e-08 EMBL CAA23831 "unnamed protein product [Homo sapiens]" 85.29 439 100.00 100.00 8.27e-08 EMBL CAA25015 "myc oncogene [Homo sapiens]" 85.29 439 100.00 100.00 8.27e-08 EMBL CAA25106 "48K protein [Homo sapiens]" 85.29 439 100.00 100.00 8.27e-08 GB AAA36340 "c-myc protein, first expressed, partial [Homo sapiens]" 85.29 439 100.00 100.00 8.27e-08 GB AAA59880 "c-myc protein [Homo sapiens]" 85.29 439 100.00 100.00 8.27e-08 GB AAA59881 "c-myc protein, first translated, partial [Homo sapiens]" 85.29 439 100.00 100.00 8.27e-08 GB AAA59882 "c-myc protein, second translated, partial [Homo sapiens]" 85.29 439 100.00 100.00 8.27e-08 GB AAA72907 "unnamed protein product [Pan troglodytes]" 85.29 439 100.00 100.00 8.27e-08 PRF 0903253A "c-myc gene" 85.29 439 100.00 100.00 8.27e-08 PRF 0907235A "protein c-myc" 85.29 439 100.00 100.00 8.27e-08 PRF 1001205A "c-myc gene" 85.29 440 100.00 100.00 9.14e-08 PRF 2122337A "myc protein" 85.29 439 100.00 100.00 8.35e-08 REF NP_001136266 "myc proto-oncogene protein [Pan troglodytes]" 85.29 454 100.00 100.00 6.58e-08 REF NP_002458 "myc proto-oncogene protein [Homo sapiens]" 85.29 454 100.00 100.00 6.58e-08 REF XP_003820503 "PREDICTED: myc proto-oncogene protein [Pan paniscus]" 85.29 439 100.00 100.00 8.19e-08 REF XP_004047574 "PREDICTED: myc proto-oncogene protein [Gorilla gorilla gorilla]" 85.29 439 100.00 100.00 8.35e-08 REF XP_008972161 "PREDICTED: myc proto-oncogene protein [Pan paniscus]" 85.29 439 100.00 100.00 8.19e-08 SP A1YG22 "RecName: Full=Myc proto-oncogene protein; AltName: Full=Proto-oncogene c-Myc; AltName: Full=Transcription factor p64" 85.29 439 100.00 100.00 8.19e-08 SP P01106 "RecName: Full=Myc proto-oncogene protein; AltName: Full=Class E basic helix-loop-helix protein 39; Short=bHLHe39; AltName: Full" 85.29 439 100.00 100.00 8.27e-08 SP P23583 "RecName: Full=Myc proto-oncogene protein; AltName: Full=Proto-oncogene c-Myc; AltName: Full=Transcription factor p64" 85.29 439 100.00 100.00 8.27e-08 stop_ save_ save_Max_Leucine_Zipper_Chain_B _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common 'Max Leucine Zipper Domain' _Abbreviation_common 'Max LZ' _Molecular_mass 3793 _Mol_thiol_state 'not present' _Details ; There is a Cys-Gly-Gly linker at the N-terminus for cross-linking to the c-myc LZ ; _Residue_count 34 _Mol_residue_sequence ; XCGGMRRKNDTHQQDIDDLK RQNALLEQQVRALX ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 0 ACE 2 1 CYS 3 2 GLY 4 3 GLY 5 4 MET 6 5 ARG 7 6 ARG 8 7 LYS 9 8 ASN 10 9 ASP 11 10 THR 12 11 HIS 13 12 GLN 14 13 GLN 15 14 ASP 16 15 ILE 17 16 ASP 18 17 ASP 19 18 LEU 20 19 LYS 21 20 ARG 22 21 GLN 23 22 ASN 24 23 ALA 25 24 LEU 26 25 LEU 27 26 GLU 28 27 GLN 29 28 GLN 30 29 VAL 31 30 ARG 32 31 ALA 33 32 LEU 34 33 NH2 stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date . save_ ###################### # Polymer residues # ###################### save_chem_comp_ACE _Saveframe_category polymer_residue _Mol_type NON-POLYMER _Name_common 'ACETYL GROUP' _BMRB_code ACE _PDB_code ACE _Standard_residue_derivative . _Molecular_mass 44.053 _Mol_paramagnetic . _Details . loop_ _Atom_name _PDB_atom_name _Atom_type _Atom_chirality _Atom_charge _Atom_oxidation_number _Atom_unpaired_electrons C C C . 0 . ? O O O . 0 . ? CH3 CH3 C . 0 . ? H H H . 0 . ? H1 H1 H . 0 . ? H2 H2 H . 0 . ? H3 H3 H . 0 . ? stop_ loop_ _Bond_order _Bond_atom_one_atom_name _Bond_atom_two_atom_name _PDB_bond_atom_one_atom_name _PDB_bond_atom_two_atom_name DOUB C O ? ? SING C CH3 ? ? SING C H ? ? SING CH3 H1 ? ? SING CH3 H2 ? ? SING CH3 H3 ? ? stop_ save_ save_chem_comp_NH2 _Saveframe_category polymer_residue _Mol_type NON-POLYMER _Name_common 'AMINO GROUP' _BMRB_code NH2 _PDB_code NH2 _Standard_residue_derivative . _Molecular_mass 16.023 _Mol_paramagnetic . _Details . loop_ _Atom_name _PDB_atom_name _Atom_type _Atom_chirality _Atom_charge _Atom_oxidation_number _Atom_unpaired_electrons N N N . 0 . ? HN1 HN1 H . 0 . ? HN2 HN2 H . 0 . ? stop_ loop_ _Bond_order _Bond_atom_one_atom_name _Bond_atom_two_atom_name _PDB_bond_atom_one_atom_name _PDB_bond_atom_two_atom_name SING N HN1 ? ? SING N HN2 ? ? stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species _Details $c-Myc-Max_Leucine_Zipper_Chain_A Human 9606 Eukaryota Metazoa Homo sapiens 'c-Myc is a nuclear protein' $Max_Leucine_Zipper_Chain_B mouse 10090 Eukaryota Metazoa mus musculus 'Max is a nuclear protein' stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Saveframe_category experimental_source loop_ _Mol_label _Production_method _Host_organism_name_common _Genus _Species _Strain _Vector_name $c-Myc-Max_Leucine_Zipper_Chain_A 'chemical synthesis' . . . . . $Max_Leucine_Zipper_Chain_B 'chemical synthesis' . . . . . stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_one _Saveframe_category sample _Sample_type solution _Details ; The sample is a heterodimer consisting of disulfide-linked Leucine Zipper domains of c-Myc (chain A) and Max (chain B) ; loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $c-Myc-Max_Leucine_Zipper_Chain_A 1.0 mM . 'potassium phosphate' 50 mM . H2O 90 % . D2O 10 % . KCl 50 mM . DSS 1 mM . stop_ save_ ############################ # Computer software used # ############################ save_VNMR _Saveframe_category software _Name VNMR _Version 5.2 _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_one _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model VXR _Field_strength 500 _Details . save_ save_NMR_spectrometer_two _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model Unity _Field_strength 600 _Details . save_ ############################# # NMR applied experiments # ############################# save__1 _Saveframe_category NMR_applied_experiment _Sample_label $sample_one save_ save_NMR_applied_experiment_one _Saveframe_category NMR_applied_experiment _Experiment_name . _BMRB_pulse_sequence_accession_number . _Details ; NOESY TOCSY DQF-COSY ; save_ ####################### # Sample conditions # ####################### save_sample_conditions _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units 'ionic strength' 0.1 . M pH 4.8 0.3 na temperature 298.15 0.2 K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference _Saveframe_category chemical_shift_reference _Details . loop_ _Mol_common_name _Atom_type _Atom_isotope_number _Atom_group _Chem_shift_units _Chem_shift_value _Reference_method _Reference_type _External_reference_sample_geometry _External_reference_location _External_reference_axis _Indirect_shift_ratio _Indirect_shift_ratio_citation_label DSS H 1 'methyl protons' ppm 0.00 internal direct . . . 1.0 $reference_one 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_chemical_shifts_one _Saveframe_category assigned_chemical_shifts _Details . loop_ _Sample_label $sample_one stop_ _Sample_conditions_label $sample_conditions _Chem_shift_reference_set_label $chemical_shift_reference _Mol_system_component_name 'c-Myc LZ Chain A' _Text_data_format . _Text_data . loop_ _Atom_shift_assign_ID _Residue_author_seq_code _Residue_seq_code _Residue_label _Atom_name _Atom_type _Chem_shift_value _Chem_shift_value_error _Chem_shift_ambiguity_code 1 . 5 VAL H H 8.68 0.02 1 2 . 5 VAL HA H 3.73 0.02 1 3 . 5 VAL HB H 2.25 0.02 1 4 . 5 VAL HG2 H 1.04 0.02 2 5 . 5 VAL HG1 H 0.94 0.02 2 6 . 6 GLN H H 8.35 0.02 1 7 . 6 GLN HA H 4.32 0.02 1 8 . 6 GLN HB2 H 2.13 0.02 1 9 . 6 GLN HB3 H 2.13 0.02 1 10 . 6 GLN HG2 H 2.58 0.02 1 11 . 6 GLN HG3 H 2.58 0.02 1 12 . 7 ALA H H 8.26 0.02 1 13 . 7 ALA HA H 4.20 0.02 1 14 . 7 ALA HB H 1.48 0.02 1 15 . 8 GLU H H 8.15 0.02 1 16 . 8 GLU HB3 H 2.16 0.02 2 17 . 8 GLU HG2 H 2.32 0.02 2 18 . 8 GLU HG3 H 2.40 0.02 2 19 . 9 GLU H H 8.73 0.02 1 20 . 9 GLU HA H 3.99 0.02 1 21 . 9 GLU HB2 H 1.88 0.02 2 22 . 9 GLU HB3 H 2.14 0.02 2 23 . 9 GLU HG2 H 2.29 0.02 2 24 . 9 GLU HG3 H 2.53 0.02 2 25 . 10 GLN H H 8.36 0.02 1 26 . 10 GLN HA H 3.95 0.02 1 27 . 10 GLN HB2 H 2.05 0.02 2 28 . 10 GLN HB3 H 2.34 0.02 2 29 . 10 GLN HG2 H 2.49 0.02 1 30 . 10 GLN HG3 H 2.49 0.02 1 31 . 11 LYS H H 8.69 0.02 1 32 . 11 LYS HA H 3.91 0.02 1 33 . 11 LYS HB2 H 1.72 0.02 2 34 . 11 LYS HB3 H 1.88 0.02 2 35 . 11 LYS HG3 H 1.40 0.02 1 36 . 11 LYS HG2 H 1.40 0.02 1 37 . 12 LEU H H 8.01 0.02 1 38 . 12 LEU HA H 4.13 0.02 1 39 . 12 LEU HB2 H 1.20 0.02 1 40 . 12 LEU HB3 H 1.87 0.02 4 41 . 12 LEU HG H 1.87 0.02 4 42 . 12 LEU HD1 H 0.98 0.02 1 43 . 12 LEU HD2 H 0.82 0.02 1 44 . 13 ILE H H 8.35 0.02 1 45 . 13 ILE HA H 3.62 0.02 1 46 . 13 ILE HB H 1.77 0.02 1 47 . 13 ILE HG12 H 1.33 0.02 1 48 . 13 ILE HG13 H 1.33 0.02 1 49 . 13 ILE HG2 H 0.86 0.02 1 50 . 13 ILE HD1 H 0.75 0.02 1 51 . 14 SER H H 7.95 0.02 1 52 . 14 SER HA H 4.31 0.02 1 53 . 14 SER HB2 H 4.02 0.02 1 54 . 14 SER HB3 H 4.02 0.02 1 55 . 15 GLU H H 7.99 0.02 1 56 . 15 GLU HA H 4.12 0.02 1 57 . 15 GLU HB2 H 2.19 0.02 1 58 . 15 GLU HB3 H 2.19 0.02 1 59 . 16 GLU H H 8.69 0.02 1 60 . 16 GLU HA H 3.99 0.02 1 61 . 16 GLU HB2 H 2.11 0.02 2 62 . 16 GLU HB3 H 2.21 0.02 4 63 . 16 GLU HG2 H 2.25 0.02 4 64 . 16 GLU HG3 H 2.25 0.02 4 65 . 17 ASP H H 8.34 0.02 1 66 . 17 ASP HA H 4.40 0.02 1 67 . 17 ASP HB2 H 2.73 0.02 2 68 . 17 ASP HB3 H 2.87 0.02 2 69 . 18 LEU H H 7.87 0.02 1 70 . 18 LEU HA H 4.09 0.02 1 71 . 18 LEU HB2 H 1.84 0.02 2 72 . 18 LEU HB3 H 1.94 0.02 2 73 . 18 LEU HG H 1.72 0.02 1 74 . 19 LEU H H 8.35 0.02 1 75 . 19 LEU HA H 4.03 0.02 1 76 . 19 LEU HB2 H 2.17 0.02 1 77 . 19 LEU HB3 H 1.31 0.02 1 78 . 19 LEU HG H 1.95 0.02 1 79 . 19 LEU HD1 H 1.04 0.02 1 80 . 19 LEU HD2 H 0.88 0.02 1 81 . 20 ARG H H 8.74 0.02 1 82 . 20 ARG HA H 3.99 0.02 1 83 . 20 ARG HB2 H 1.97 0.02 2 84 . 20 ARG HB3 H 2.08 0.02 2 85 . 20 ARG HG2 H 1.63 0.02 1 86 . 20 ARG HG3 H 1.63 0.02 1 87 . 20 ARG HD2 H 3.27 0.02 1 88 . 20 ARG HD3 H 3.27 0.02 1 89 . 22 ARG H H 8.11 0.02 1 90 . 22 ARG HA H 4.15 0.02 1 91 . 22 ARG HB2 H 2.00 0.02 4 92 . 22 ARG HB3 H 2.00 0.02 4 93 . 22 ARG HG2 H 2.00 0.02 4 94 . 22 ARG HG3 H 2.00 0.02 4 95 . 22 ARG HD2 H 3.14 0.02 2 96 . 22 ARG HD3 H 3.33 0.02 2 97 . 22 ARG HE H 7.37 0.02 1 98 . 23 ARG H H 8.27 0.02 1 99 . 23 ARG HA H 3.99 0.02 1 100 . 23 ARG HB2 H 2.16 0.02 2 101 . 23 ARG HB3 H 2.43 0.02 2 102 . 23 ARG HG2 H 1.43 0.02 2 103 . 23 ARG HG3 H 1.78 0.02 2 104 . 23 ARG HD2 H 2.99 0.02 2 105 . 23 ARG HD3 H 3.29 0.02 2 106 . 23 ARG HE H 7.41 0.02 1 107 . 24 GLU H H 7.80 0.02 1 108 . 24 GLU HA H 3.98 0.02 1 109 . 24 GLU HB2 H 2.16 0.02 1 110 . 24 GLU HB3 H 2.16 0.02 1 111 . 24 GLU HG2 H 2.41 0.02 1 112 . 24 GLU HG3 H 2.41 0.02 1 113 . 25 GLN H H 8.04 0.02 1 114 . 25 GLN HA H 4.14 0.02 1 115 . 25 GLN HB2 H 2.37 0.02 1 116 . 25 GLN HB3 H 2.37 0.02 1 117 . 25 GLN HG2 H 2.63 0.02 1 118 . 25 GLN HG3 H 2.63 0.02 1 119 . 26 LEU H H 8.19 0.02 1 120 . 26 LEU HA H 4.10 0.02 1 121 . 26 LEU HB2 H 2.17 0.02 1 122 . 26 LEU HB3 H 1.26 0.02 1 123 . 26 LEU HG H 1.77 0.02 1 124 . 26 LEU HD1 H 0.95 0.02 1 125 . 26 LEU HD2 H 0.83 0.02 1 126 . 27 LYS H H 8.69 0.02 1 127 . 28 HIS H H 8.19 0.02 1 128 . 28 HIS HA H 4.56 0.02 1 129 . 28 HIS HB2 H 3.39 0.02 1 130 . 28 HIS HB3 H 3.39 0.02 1 131 . 28 HIS HD2 H 7.39 0.02 1 132 . 28 HIS HE1 H 8.61 0.02 1 133 . 29 LYS H H 8.11 0.02 1 134 . 29 LYS HA H 3.97 0.02 1 135 . 30 LEU H H 8.23 0.02 1 136 . 30 LEU HA H 4.00 0.02 1 137 . 30 LEU HB3 H 2.02 0.02 4 138 . 30 LEU HB2 H 1.73 0.02 4 139 . 30 LEU HG H 1.64 0.02 4 140 . 30 LEU HD1 H 1.03 0.02 1 141 . 30 LEU HD2 H 0.88 0.02 1 142 . 31 GLU H H 7.90 0.02 1 143 . 31 GLU HA H 4.04 0.02 1 144 . 31 GLU HB2 H 2.14 0.02 2 145 . 31 GLU HB3 H 2.25 0.02 4 146 . 31 GLU HG2 H 2.37 0.02 4 147 . 31 GLU HG3 H 2.52 0.02 2 148 . 32 GLN H H 7.75 0.02 1 149 . 32 GLN HA H 4.11 0.02 1 150 . 32 GLN HB2 H 2.18 0.02 1 151 . 32 GLN HB3 H 2.18 0.02 4 152 . 32 GLN HG2 H 2.29 0.02 4 153 . 32 GLN HG3 H 2.40 0.02 2 154 . 33 LEU H H 7.88 0.02 1 155 . 33 LEU HA H 4.26 0.02 1 156 . 33 LEU HB2 H 1.59 0.02 2 157 . 33 LEU HB3 H 1.84 0.02 4 158 . 33 LEU HG H 1.84 0.02 4 159 . 33 LEU HD1 H 0.93 0.02 1 160 . 33 LEU HD2 H 0.93 0.02 1 stop_ save_ save_assigned_chemical_shifts_two _Saveframe_category assigned_chemical_shifts _Details . loop_ _Sample_label $sample_one stop_ _Sample_conditions_label $sample_conditions _Chem_shift_reference_set_label $chemical_shift_reference _Mol_system_component_name 'Max LZ Chain B' _Text_data_format . _Text_data . loop_ _Atom_shift_assign_ID _Residue_author_seq_code _Residue_seq_code _Residue_label _Atom_name _Atom_type _Chem_shift_value _Chem_shift_value_error _Chem_shift_ambiguity_code 1 . 6 ARG HA H 4.14 0.02 1 2 . 7 ARG HA H 4.25 0.02 1 3 . 8 LYS HA H 4.24 0.02 1 4 . 9 ASN H H 8.37 0.02 1 5 . 9 ASN HA H 4.62 0.02 1 6 . 9 ASN HB2 H 2.93 0.02 1 7 . 9 ASN HB3 H 2.80 0.02 1 8 . 9 ASN HD21 H 7.63 0.02 1 9 . 9 ASN HD22 H 6.41 0.02 1 10 . 10 ASP H H 8.31 0.02 1 11 . 10 ASP HA H 4.55 0.02 1 12 . 10 ASP HB3 H 2.86 0.02 2 13 . 10 ASP HB2 H 2.75 0.02 2 14 . 11 THR H H 8.12 0.02 1 15 . 11 THR HA H 4.08 0.02 1 16 . 11 THR HB H 4.23 0.02 1 17 . 11 THR HG2 H 1.20 0.02 1 18 . 12 HIS H H 8.30 0.02 1 19 . 12 HIS HA H 4.67 0.02 1 20 . 12 HIS HB2 H 3.19 0.02 1 21 . 12 HIS HB3 H 3.47 0.02 1 22 . 12 HIS HD2 H 7.53 0.02 1 23 . 12 HIS HE1 H 8.63 0.02 1 24 . 13 GLN H H 8.63 0.02 1 25 . 13 GLN HA H 4.00 0.02 1 26 . 13 GLN HB2 H 1.88 0.02 2 27 . 13 GLN HB3 H 2.23 0.02 2 28 . 13 GLN HG2 H 2.40 0.02 1 29 . 13 GLN HG3 H 2.40 0.02 1 30 . 13 GLN HE21 H 7.61 0.02 1 31 . 13 GLN HE22 H 6.73 0.02 1 32 . 14 GLN H H 8.14 0.02 1 33 . 14 GLN HA H 4.17 0.02 1 34 . 14 GLN HB2 H 2.49 0.02 4 35 . 14 GLN HB3 H 2.49 0.02 4 36 . 14 GLN HG2 H 2.49 0.02 4 37 . 14 GLN HG3 H 2.49 0.02 4 38 . 15 ASP H H 8.11 0.02 1 39 . 15 ASP HA H 4.55 0.02 1 40 . 15 ASP HB2 H 2.88 0.02 2 41 . 15 ASP HB3 H 3.07 0.02 2 42 . 16 ILE H H 8.47 0.02 1 43 . 16 ILE HA H 3.55 0.02 1 44 . 16 ILE HB H 2.08 0.02 1 45 . 16 ILE HG12 H 0.78 0.02 2 46 . 16 ILE HG13 H 1.00 0.02 2 47 . 16 ILE HG2 H 0.88 0.02 1 48 . 16 ILE HD1 H 0.84 0.02 1 49 . 17 ASP H H 8.50 0.02 1 50 . 17 ASP HA H 4.36 0.02 1 51 . 17 ASP HB2 H 2.69 0.02 2 52 . 17 ASP HB3 H 2.84 0.02 2 53 . 18 ASP H H 8.21 0.02 1 54 . 18 ASP HA H 4.51 0.02 1 55 . 18 ASP HB2 H 2.84 0.02 2 56 . 18 ASP HB3 H 2.94 0.02 2 57 . 19 LEU H H 8.54 0.02 1 58 . 19 LEU HA H 3.98 0.02 1 59 . 19 LEU HB2 H 2.17 0.02 1 60 . 19 LEU HB3 H 1.29 0.02 1 61 . 19 LEU HG H 1.87 0.02 1 62 . 19 LEU HD1 H 0.95 0.02 1 63 . 19 LEU HD2 H 0.84 0.02 1 64 . 20 LYS H H 8.77 0.02 1 65 . 20 LYS HA H 3.96 0.02 1 66 . 20 LYS HB2 H 1.88 0.02 1 67 . 20 LYS HB3 H 1.88 0.02 1 68 . 20 LYS HG2 H 1.42 0.02 1 69 . 20 LYS HG3 H 1.42 0.02 1 70 . 20 LYS HD2 H 1.74 0.02 1 71 . 20 LYS HD3 H 1.74 0.02 1 72 . 20 LYS HE2 H 2.86 0.02 1 73 . 20 LYS HE3 H 2.86 0.02 1 74 . 21 ARG H H 7.77 0.02 1 75 . 21 ARG HA H 4.14 0.02 1 76 . 21 ARG HB2 H 1.85 0.02 2 77 . 21 ARG HB3 H 2.09 0.02 2 78 . 21 ARG HG2 H 1.61 0.02 1 79 . 21 ARG HG3 H 1.61 0.02 1 80 . 21 ARG HD2 H 3.30 0.02 1 81 . 21 ARG HD3 H 3.30 0.02 1 82 . 21 ARG HE H 7.41 0.02 1 83 . 22 GLN H H 8.68 0.02 1 84 . 22 GLN HA H 4.01 0.02 1 85 . 22 GLN HB2 H 1.97 0.02 2 86 . 22 GLN HB3 H 2.14 0.02 2 87 . 22 GLN HG2 H 2.36 0.02 2 88 . 22 GLN HG3 H 2.65 0.02 2 89 . 22 GLN HE21 H 7.45 0.02 1 90 . 22 GLN HE22 H 6.88 0.02 1 91 . 23 ASN H H 8.98 0.02 1 92 . 23 ASN HA H 4.51 0.02 1 93 . 23 ASN HB2 H 2.84 0.02 1 94 . 23 ASN HB3 H 2.57 0.02 1 95 . 23 ASN HD21 H 6.82 0.02 1 96 . 23 ASN HD22 H 6.19 0.02 1 97 . 24 ALA H H 7.89 0.02 1 98 . 24 ALA HA H 4.25 0.02 1 99 . 24 ALA HB H 1.56 0.02 1 100 . 25 LEU H H 7.58 0.02 1 101 . 25 LEU HA H 4.21 0.02 1 102 . 25 LEU HB2 H 1.62 0.02 4 103 . 25 LEU HB3 H 1.82 0.02 4 104 . 25 LEU HG H 1.72 0.02 4 105 . 25 LEU HD1 H 0.90 0.02 1 106 . 25 LEU HD2 H 0.90 0.02 1 107 . 26 LEU H H 8.19 0.02 1 108 . 26 LEU HA H 4.18 0.02 1 109 . 26 LEU HB2 H 2.15 0.02 1 110 . 26 LEU HB3 H 1.33 0.02 1 111 . 26 LEU HG H 1.88 0.02 1 112 . 26 LEU HD1 H 1.03 0.02 1 113 . 26 LEU HD2 H 0.87 0.02 1 114 . 27 GLU H H 8.81 0.02 1 115 . 27 GLU HA H 3.88 0.02 1 116 . 27 GLU HB2 H 2.05 0.02 2 117 . 27 GLU HB3 H 2.23 0.02 2 118 . 27 GLU HG2 H 2.49 0.02 2 119 . 27 GLU HG3 H 2.61 0.02 2 120 . 28 GLN H H 7.72 0.02 1 121 . 28 GLN HA H 4.10 0.02 1 122 . 28 GLN HB2 H 1.96 0.02 2 123 . 28 GLN HB3 H 2.18 0.02 2 124 . 28 GLN HG2 H 2.31 0.02 2 125 . 28 GLN HG3 H 2.62 0.02 2 126 . 29 GLN H H 8.02 0.02 1 127 . 29 GLN HA H 4.11 0.02 1 128 . 29 GLN HB2 H 1.89 0.02 2 129 . 29 GLN HB3 H 2.16 0.02 2 130 . 29 GLN HG2 H 2.38 0.02 2 131 . 29 GLN HG3 H 2.62 0.02 2 132 . 29 GLN HE21 H 7.13 0.02 1 133 . 29 GLN HE22 H 6.66 0.02 1 134 . 30 VAL H H 8.50 0.02 1 135 . 30 VAL HA H 3.51 0.02 1 136 . 30 VAL HB H 2.21 0.02 1 137 . 30 VAL HG1 H 1.02 0.02 1 138 . 30 VAL HG2 H 0.87 0.02 1 139 . 31 ARG H H 8.07 0.02 1 140 . 31 ARG HA H 4.01 0.02 1 141 . 31 ARG HB2 H 1.92 0.02 2 142 . 31 ARG HB3 H 2.17 0.02 2 143 . 31 ARG HG2 H 1.66 0.02 2 144 . 31 ARG HG3 H 1.83 0.02 2 145 . 31 ARG HD2 H 3.21 0.02 2 146 . 31 ARG HD3 H 3.25 0.02 2 147 . 31 ARG HE H 7.36 0.02 1 148 . 32 ALA H H 7.83 0.02 1 149 . 32 ALA HA H 4.19 0.02 1 150 . 32 ALA HB H 1.50 0.02 1 151 . 33 LEU H H 7.56 0.02 1 152 . 33 LEU HA H 4.26 0.02 1 153 . 33 LEU HB2 H 1.60 0.02 4 154 . 33 LEU HB3 H 1.82 0.02 4 155 . 33 LEU HG H 1.82 0.02 4 156 . 33 LEU HD1 H 1.03 0.02 2 157 . 33 LEU HD2 H 0.87 0.02 2 stop_ save_