data_16821 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 16821 _Entry.Title ; SOLUTION NMR STRUCTURE OF TETRATRICOPEPTIDE REPEAT DOMAIN PROTEIN SRU_0103 FROM SALINIBACTER RUBER, NORTHEAST STRUCTURAL GENOMICS CONSORTIUM (NESG) TARGET SRR115C ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2010-04-01 _Entry.Accession_date 2010-04-01 _Entry.Last_release_date 2012-08-03 _Entry.Original_release_date 2012-08-03 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.9.13 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _Entry.Details 'The structure was refined with RDC constraints in addition to NOE distance and dihedral angle constraints.' _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 Gaohua Liu . . . 16821 2 Paolo Rossi . . . 16821 3 Dongyan Wang . . . 16821 4 Chioma Nwosu . . . 16821 5 Leah Owens . . . 16821 6 Rong Xiao . . . 16821 7 Jinfeng Liu . . . 16821 8 Michael Baran . C. . 16821 9 G.V.T SWAPNA . . . 16821 10 THOMAS ACTON . B. . 16821 11 BURKHARD Rost . . . 16821 12 Gaetano Montelione . T. . 16821 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 'PSI, Protein Structure Initiative' 'Northeast Structural Genomics Consortium' . 16821 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'GFT NMR' . 16821 NESG . 16821 RDC . 16821 'TETRATRICOPEPTIDE REPEAT' . 16821 TPR . 16821 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID RDCs 1 16821 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID 'residual dipolar couplings' 70 16821 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 . . 2012-08-03 2010-04-01 original author . 16821 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 16084 'NMR chemical shifts' 16821 PDB 2kcl 'NMR structure refined without RDC constraints' 16821 PDB 2KCV 'BMRB Entry Tracking System' 16821 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 16821 _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 'SOLUTION NMR STRUCTURE OF TETRATRICOPEPTIDE REPEAT DOMAIN PROTEIN SRU_0103 FROM SALINIBACTER RUBER, NORTHEAST STRUCTURAL GENOMICS CONSORTIUM (NESG) TARGET SRR115C' _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev 'Not known' _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.Entry_ID _Citation_author.Citation_ID 1 Gaohua Liu . . . 16821 1 2 Gaetano Montelione . . . 16821 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 16821 _Assembly.ID 1 _Assembly.Name SRU_0103 _Assembly.BMRB_code . _Assembly.Number_of_components 1 _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 SRU_0103 1 $SRU_0103 A . yes native no no . . . 16821 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_SRU_0103 _Entity.Sf_category entity _Entity.Sf_framecode SRU_0103 _Entity.Entry_ID 16821 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name SRU_0103 _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 ; EDPEDPFTRYALAQEHLKHD NASRALALFEELVETDPDYV GTYYHLGKLYERLDRTDDAI DTYAQGIEVAREEGTQKDLS ELQDAKLKAEGLEHHHHHHE DPEDPFTRYALAQEHLKHDN ASRALALFEELVETDPDYVG TYYHLGKLYERLDRTDDAID TYAQGIEVAREEGTQKDLSE LQDAKLKAEGLEHHHHHH ; _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 198 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 22957.064 _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 no BMRB 16084 . SRU_0103 . . . . . 50.00 99 100.00 100.00 5.11e-61 . . . . 16821 1 2 no PDB 2KCL . "Solution Nmr Structure Of Tetratricopeptide Repeat Domain Protein Sru_0103 From Salinibacter Ruber, Northeast Structural Genomi" . . . . . 50.00 99 100.00 100.00 5.11e-61 . . . . 16821 1 3 no PDB 2KCV . "Solution Nmr Structure Of Tetratricopeptide Repeat Domain Protein Sru_0103 From Salinibacter Ruber, Northeast Structural Genomi" . . . . . 50.00 99 100.00 100.00 5.11e-61 . . . . 16821 1 4 no PDB 3MA5 . "Crystal Structure Of The Tetratricopeptide Repeat Domain Protein Q2s6c5_salrd From Salinibacter Ruber. Northeast Structural Gen" . . . . . 50.00 100 100.00 100.00 5.51e-61 . . . . 16821 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 . GLU . 16821 1 2 . ASP . 16821 1 3 . PRO . 16821 1 4 . GLU . 16821 1 5 . ASP . 16821 1 6 . PRO . 16821 1 7 . PHE . 16821 1 8 . THR . 16821 1 9 . ARG . 16821 1 10 . TYR . 16821 1 11 . ALA . 16821 1 12 . LEU . 16821 1 13 . ALA . 16821 1 14 . GLN . 16821 1 15 . GLU . 16821 1 16 . HIS . 16821 1 17 . LEU . 16821 1 18 . LYS . 16821 1 19 . HIS . 16821 1 20 . ASP . 16821 1 21 . ASN . 16821 1 22 . ALA . 16821 1 23 . SER . 16821 1 24 . ARG . 16821 1 25 . ALA . 16821 1 26 . LEU . 16821 1 27 . ALA . 16821 1 28 . LEU . 16821 1 29 . PHE . 16821 1 30 . GLU . 16821 1 31 . GLU . 16821 1 32 . LEU . 16821 1 33 . VAL . 16821 1 34 . GLU . 16821 1 35 . THR . 16821 1 36 . ASP . 16821 1 37 . PRO . 16821 1 38 . ASP . 16821 1 39 . TYR . 16821 1 40 . VAL . 16821 1 41 . GLY . 16821 1 42 . THR . 16821 1 43 . TYR . 16821 1 44 . TYR . 16821 1 45 . HIS . 16821 1 46 . LEU . 16821 1 47 . GLY . 16821 1 48 . LYS . 16821 1 49 . LEU . 16821 1 50 . TYR . 16821 1 51 . GLU . 16821 1 52 . ARG . 16821 1 53 . LEU . 16821 1 54 . ASP . 16821 1 55 . ARG . 16821 1 56 . THR . 16821 1 57 . ASP . 16821 1 58 . ASP . 16821 1 59 . ALA . 16821 1 60 . ILE . 16821 1 61 . ASP . 16821 1 62 . THR . 16821 1 63 . TYR . 16821 1 64 . ALA . 16821 1 65 . GLN . 16821 1 66 . GLY . 16821 1 67 . ILE . 16821 1 68 . GLU . 16821 1 69 . VAL . 16821 1 70 . ALA . 16821 1 71 . ARG . 16821 1 72 . GLU . 16821 1 73 . GLU . 16821 1 74 . GLY . 16821 1 75 . THR . 16821 1 76 . GLN . 16821 1 77 . LYS . 16821 1 78 . ASP . 16821 1 79 . LEU . 16821 1 80 . SER . 16821 1 81 . GLU . 16821 1 82 . LEU . 16821 1 83 . GLN . 16821 1 84 . ASP . 16821 1 85 . ALA . 16821 1 86 . LYS . 16821 1 87 . LEU . 16821 1 88 . LYS . 16821 1 89 . ALA . 16821 1 90 . GLU . 16821 1 91 . GLY . 16821 1 92 . LEU . 16821 1 93 . GLU . 16821 1 94 . HIS . 16821 1 95 . HIS . 16821 1 96 . HIS . 16821 1 97 . HIS . 16821 1 98 . HIS . 16821 1 99 . HIS . 16821 1 100 . GLU . 16821 1 101 . ASP . 16821 1 102 . PRO . 16821 1 103 . GLU . 16821 1 104 . ASP . 16821 1 105 . PRO . 16821 1 106 . PHE . 16821 1 107 . THR . 16821 1 108 . ARG . 16821 1 109 . TYR . 16821 1 110 . ALA . 16821 1 111 . LEU . 16821 1 112 . ALA . 16821 1 113 . GLN . 16821 1 114 . GLU . 16821 1 115 . HIS . 16821 1 116 . LEU . 16821 1 117 . LYS . 16821 1 118 . HIS . 16821 1 119 . ASP . 16821 1 120 . ASN . 16821 1 121 . ALA . 16821 1 122 . SER . 16821 1 123 . ARG . 16821 1 124 . ALA . 16821 1 125 . LEU . 16821 1 126 . ALA . 16821 1 127 . LEU . 16821 1 128 . PHE . 16821 1 129 . GLU . 16821 1 130 . GLU . 16821 1 131 . LEU . 16821 1 132 . VAL . 16821 1 133 . GLU . 16821 1 134 . THR . 16821 1 135 . ASP . 16821 1 136 . PRO . 16821 1 137 . ASP . 16821 1 138 . TYR . 16821 1 139 . VAL . 16821 1 140 . GLY . 16821 1 141 . THR . 16821 1 142 . TYR . 16821 1 143 . TYR . 16821 1 144 . HIS . 16821 1 145 . LEU . 16821 1 146 . GLY . 16821 1 147 . LYS . 16821 1 148 . LEU . 16821 1 149 . TYR . 16821 1 150 . GLU . 16821 1 151 . ARG . 16821 1 152 . LEU . 16821 1 153 . ASP . 16821 1 154 . ARG . 16821 1 155 . THR . 16821 1 156 . ASP . 16821 1 157 . ASP . 16821 1 158 . ALA . 16821 1 159 . ILE . 16821 1 160 . ASP . 16821 1 161 . THR . 16821 1 162 . TYR . 16821 1 163 . ALA . 16821 1 164 . GLN . 16821 1 165 . GLY . 16821 1 166 . ILE . 16821 1 167 . GLU . 16821 1 168 . VAL . 16821 1 169 . ALA . 16821 1 170 . ARG . 16821 1 171 . GLU . 16821 1 172 . GLU . 16821 1 173 . GLY . 16821 1 174 . THR . 16821 1 175 . GLN . 16821 1 176 . LYS . 16821 1 177 . ASP . 16821 1 178 . LEU . 16821 1 179 . SER . 16821 1 180 . GLU . 16821 1 181 . LEU . 16821 1 182 . GLN . 16821 1 183 . ASP . 16821 1 184 . ALA . 16821 1 185 . LYS . 16821 1 186 . LEU . 16821 1 187 . LYS . 16821 1 188 . ALA . 16821 1 189 . GLU . 16821 1 190 . GLY . 16821 1 191 . LEU . 16821 1 192 . GLU . 16821 1 193 . HIS . 16821 1 194 . HIS . 16821 1 195 . HIS . 16821 1 196 . HIS . 16821 1 197 . HIS . 16821 1 198 . HIS . 16821 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 . GLU 1 1 16821 1 . ASP 2 2 16821 1 . PRO 3 3 16821 1 . GLU 4 4 16821 1 . ASP 5 5 16821 1 . PRO 6 6 16821 1 . PHE 7 7 16821 1 . THR 8 8 16821 1 . ARG 9 9 16821 1 . TYR 10 10 16821 1 . ALA 11 11 16821 1 . LEU 12 12 16821 1 . ALA 13 13 16821 1 . GLN 14 14 16821 1 . GLU 15 15 16821 1 . HIS 16 16 16821 1 . LEU 17 17 16821 1 . LYS 18 18 16821 1 . HIS 19 19 16821 1 . ASP 20 20 16821 1 . ASN 21 21 16821 1 . ALA 22 22 16821 1 . SER 23 23 16821 1 . ARG 24 24 16821 1 . ALA 25 25 16821 1 . LEU 26 26 16821 1 . ALA 27 27 16821 1 . LEU 28 28 16821 1 . PHE 29 29 16821 1 . GLU 30 30 16821 1 . GLU 31 31 16821 1 . LEU 32 32 16821 1 . VAL 33 33 16821 1 . GLU 34 34 16821 1 . THR 35 35 16821 1 . ASP 36 36 16821 1 . PRO 37 37 16821 1 . ASP 38 38 16821 1 . TYR 39 39 16821 1 . VAL 40 40 16821 1 . GLY 41 41 16821 1 . THR 42 42 16821 1 . TYR 43 43 16821 1 . TYR 44 44 16821 1 . HIS 45 45 16821 1 . LEU 46 46 16821 1 . GLY 47 47 16821 1 . LYS 48 48 16821 1 . LEU 49 49 16821 1 . TYR 50 50 16821 1 . GLU 51 51 16821 1 . ARG 52 52 16821 1 . LEU 53 53 16821 1 . ASP 54 54 16821 1 . ARG 55 55 16821 1 . THR 56 56 16821 1 . ASP 57 57 16821 1 . ASP 58 58 16821 1 . ALA 59 59 16821 1 . ILE 60 60 16821 1 . ASP 61 61 16821 1 . THR 62 62 16821 1 . TYR 63 63 16821 1 . ALA 64 64 16821 1 . GLN 65 65 16821 1 . GLY 66 66 16821 1 . ILE 67 67 16821 1 . GLU 68 68 16821 1 . VAL 69 69 16821 1 . ALA 70 70 16821 1 . ARG 71 71 16821 1 . GLU 72 72 16821 1 . GLU 73 73 16821 1 . GLY 74 74 16821 1 . THR 75 75 16821 1 . GLN 76 76 16821 1 . LYS 77 77 16821 1 . ASP 78 78 16821 1 . LEU 79 79 16821 1 . SER 80 80 16821 1 . GLU 81 81 16821 1 . LEU 82 82 16821 1 . GLN 83 83 16821 1 . ASP 84 84 16821 1 . ALA 85 85 16821 1 . LYS 86 86 16821 1 . LEU 87 87 16821 1 . LYS 88 88 16821 1 . ALA 89 89 16821 1 . GLU 90 90 16821 1 . GLY 91 91 16821 1 . LEU 92 92 16821 1 . GLU 93 93 16821 1 . HIS 94 94 16821 1 . HIS 95 95 16821 1 . HIS 96 96 16821 1 . HIS 97 97 16821 1 . HIS 98 98 16821 1 . HIS 99 99 16821 1 . GLU 100 100 16821 1 . ASP 101 101 16821 1 . PRO 102 102 16821 1 . GLU 103 103 16821 1 . ASP 104 104 16821 1 . PRO 105 105 16821 1 . PHE 106 106 16821 1 . THR 107 107 16821 1 . ARG 108 108 16821 1 . TYR 109 109 16821 1 . ALA 110 110 16821 1 . LEU 111 111 16821 1 . ALA 112 112 16821 1 . GLN 113 113 16821 1 . GLU 114 114 16821 1 . HIS 115 115 16821 1 . LEU 116 116 16821 1 . LYS 117 117 16821 1 . HIS 118 118 16821 1 . ASP 119 119 16821 1 . ASN 120 120 16821 1 . ALA 121 121 16821 1 . SER 122 122 16821 1 . ARG 123 123 16821 1 . ALA 124 124 16821 1 . LEU 125 125 16821 1 . ALA 126 126 16821 1 . LEU 127 127 16821 1 . PHE 128 128 16821 1 . GLU 129 129 16821 1 . GLU 130 130 16821 1 . LEU 131 131 16821 1 . VAL 132 132 16821 1 . GLU 133 133 16821 1 . THR 134 134 16821 1 . ASP 135 135 16821 1 . PRO 136 136 16821 1 . ASP 137 137 16821 1 . TYR 138 138 16821 1 . VAL 139 139 16821 1 . GLY 140 140 16821 1 . THR 141 141 16821 1 . TYR 142 142 16821 1 . TYR 143 143 16821 1 . HIS 144 144 16821 1 . LEU 145 145 16821 1 . GLY 146 146 16821 1 . LYS 147 147 16821 1 . LEU 148 148 16821 1 . TYR 149 149 16821 1 . GLU 150 150 16821 1 . ARG 151 151 16821 1 . LEU 152 152 16821 1 . ASP 153 153 16821 1 . ARG 154 154 16821 1 . THR 155 155 16821 1 . ASP 156 156 16821 1 . ASP 157 157 16821 1 . ALA 158 158 16821 1 . ILE 159 159 16821 1 . ASP 160 160 16821 1 . THR 161 161 16821 1 . TYR 162 162 16821 1 . ALA 163 163 16821 1 . GLN 164 164 16821 1 . GLY 165 165 16821 1 . ILE 166 166 16821 1 . GLU 167 167 16821 1 . VAL 168 168 16821 1 . ALA 169 169 16821 1 . ARG 170 170 16821 1 . GLU 171 171 16821 1 . GLU 172 172 16821 1 . GLY 173 173 16821 1 . THR 174 174 16821 1 . GLN 175 175 16821 1 . LYS 176 176 16821 1 . ASP 177 177 16821 1 . LEU 178 178 16821 1 . SER 179 179 16821 1 . GLU 180 180 16821 1 . LEU 181 181 16821 1 . GLN 182 182 16821 1 . ASP 183 183 16821 1 . ALA 184 184 16821 1 . LYS 185 185 16821 1 . LEU 186 186 16821 1 . LYS 187 187 16821 1 . ALA 188 188 16821 1 . GLU 189 189 16821 1 . GLY 190 190 16821 1 . LEU 191 191 16821 1 . GLU 192 192 16821 1 . HIS 193 193 16821 1 . HIS 194 194 16821 1 . HIS 195 195 16821 1 . HIS 196 196 16821 1 . HIS 197 197 16821 1 . HIS 198 198 16821 1 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 16821 _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 $SRU_0103 . 146919 organism . 'Salinibacter ruber' 'Salinibacter ruber' . . Bacteria . Salinibacter ruber . . . . . . . . . . . . . . . . . . . . . 16821 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 16821 _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 $SRU_0103 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . 'pET 21-23C' . . . . . . 16821 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 16821 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% 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 entity '[U-100% 13C; U-100% 15N]' . . 1 $SRU_0103 . . 1.37 . . mM . . . . 16821 1 2 H2O 'natural abundance' . . . . . . 95 . . % . . . . 16821 1 3 D2O 'natural abundance' . . . . . . 5 . . % . . . . 16821 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 16821 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% 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 entity '[U-10% 13C; U-99% 15N]' . . 1 $SRU_0103 . . 1.05 . . mM . . . . 16821 2 2 H2O 'natural abundance' . . . . . . 95 . . % . . . . 16821 2 3 D2O 'natural abundance' . . . . . . 5 . . % . . . . 16821 2 stop_ save_ save_sample_3 _Sample.Sf_category sample _Sample.Sf_framecode sample_3 _Sample.Entry_ID 16821 _Sample.ID 3 _Sample.Type solution _Sample.Sub_type . _Sample.Details 'for RDC data collection' _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% 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 entity '[U-10% 13C; U-99% 15N]' . . 1 $SRU_0103 . . 1.09 . . mM . . . . 16821 3 2 H2O 'natural abundance' . . . . . . 95 . . % . . . . 16821 3 3 D2O 'natural abundance' . . . . . . 5 . . % . . . . 16821 3 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 16821 _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 pH 6.5 . pH 16821 1 pressure 1 . atm 16821 1 temperature 298 0.1 K 16821 1 stop_ save_ save_sample_conditions_2 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_2 _Sample_condition_list.Entry_ID 16821 _Sample_condition_list.ID 2 _Sample_condition_list.Details 'for RDC data of Sample 3, sample was aligned in Peg/hexanol' 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 pH 6.5 . pH 16821 2 pressure 1 . atm 16821 2 temperature 298 0.1 K 16821 2 stop_ save_ ############################ # Computer software used # ############################ save_CNS _Software.Sf_category software _Software.Sf_framecode CNS _Software.Entry_ID 16821 _Software.ID 1 _Software.Name CNS _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Brunger, Adams, Clore, Gros, Nilges and Read' . . 16821 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'geometry optimization' 16821 1 refinement 16821 1 'structure solution' 16821 1 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 16821 _Software.ID 2 _Software.Name CYANA _Software.Version 3.0 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 16821 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'geometry optimization' 16821 2 refinement 16821 2 'structure solution' 16821 2 stop_ save_ save_AutoStructure _Software.Sf_category software _Software.Sf_framecode AutoStructure _Software.Entry_ID 16821 _Software.ID 3 _Software.Name AutoStruct _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Huang, Tejero, Powers and Montelione' . . 16821 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 16821 3 'peak picking' 16821 3 refinement 16821 3 stop_ save_ save_PSVS _Software.Sf_category software _Software.Sf_framecode PSVS _Software.Entry_ID 16821 _Software.ID 4 _Software.Name PSVS _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bhattacharya and Montelione' . . 16821 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 16821 4 'peak picking' 16821 4 refinement 16821 4 stop_ save_ save_XEASY _Software.Sf_category software _Software.Sf_framecode XEASY _Software.Entry_ID 16821 _Software.ID 5 _Software.Name XEASY _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bartels et al.' . . 16821 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 16821 5 'peak picking' 16821 5 refinement 16821 5 stop_ save_ save_AutoAssign _Software.Sf_category software _Software.Sf_framecode AutoAssign _Software.Entry_ID 16821 _Software.ID 6 _Software.Name AutoAssign _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Zimmerman, Moseley, Kulikowski and Montelione' . . 16821 6 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 16821 6 'data analysis' 16821 6 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 16821 _Software.ID 7 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 16821 7 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 16821 7 stop_ save_ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 16821 _Software.ID 8 _Software.Name TOPSPIN _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 16821 8 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 16821 8 stop_ save_ save_VNMRJ _Software.Sf_category software _Software.Sf_framecode VNMRJ _Software.Entry_ID 16821 _Software.ID 9 _Software.Name VNMRJ _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Varian . . 16821 9 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 16821 9 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 16821 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 16821 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details 'in CABM' _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_3 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_3 _NMR_spectrometer.Entry_ID 16821 _NMR_spectrometer.ID 3 _NMR_spectrometer.Details RDC _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _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 16821 _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 . 800 . . . 16821 1 2 spectrometer_2 Varian INOVA . 600 'in CABM' . . 16821 1 3 spectrometer_3 Varian INOVA . 600 RDC . . 16821 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 16821 _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 . . . . . . . . . . . . . . . . 16821 1 2 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 16821 1 3 '2D 1H-15N HSQC-TROSY' no . . . . . . . . . . 3 $sample_3 isotropic . . 2 $sample_conditions_2 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 16821 1 4 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16821 1 5 '3D 1H-13C NOESY-aliphatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16821 1 6 '3D 1H-13C NOESY-aromatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16821 1 7 '4,3D GFT CABCACONHN' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 16821 1 8 '4,3D GFT HNNCABCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 16821 1 9 '4,3D GFT HABCABCONHN' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 16821 1 10 '3D HCCH-COSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 16821 1 11 '2D 1H-15N HSQC' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 16821 1 12 '2D 1H-13C HSQC' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 16821 1 stop_ save_ ################################ # Residual dipolar couplings # ################################ save_RDC_list_1 _RDC_list.Sf_category RDCs _RDC_list.Sf_framecode RDC_list_1 _RDC_list.Entry_ID 16821 _RDC_list.ID 1 _RDC_list.Sample_condition_list_ID 1 _RDC_list.Sample_condition_list_label $sample_conditions_1 _RDC_list.Spectrometer_frequency_1H 600 _RDC_list.Bond_length_usage_flag . _RDC_list.Dipolar_constraint_calib_method . _RDC_list.Mol_align_tensor_axial_sym_mol . _RDC_list.Mol_align_tensor_rhombic_mol . _RDC_list.General_order_param_int_motions . _RDC_list.Assumed_H_N_bond_length . _RDC_list.Assumed_H_C_bond_length . _RDC_list.Assumed_C_N_bond_length . _RDC_list.Details . _RDC_list.Text_data_format . _RDC_list.Text_data . loop_ _RDC_experiment.Experiment_ID _RDC_experiment.Experiment_name _RDC_experiment.Sample_ID _RDC_experiment.Sample_label _RDC_experiment.Sample_state _RDC_experiment.Entry_ID _RDC_experiment.RDC_list_ID 1 '2D 1H-15N HSQC' . . . 16821 1 stop_ loop_ _RDC.ID _RDC.RDC_code _RDC.Assembly_atom_ID_1 _RDC.Entity_assembly_ID_1 _RDC.Entity_ID_1 _RDC.Comp_index_ID_1 _RDC.Seq_ID_1 _RDC.Comp_ID_1 _RDC.Atom_ID_1 _RDC.Atom_type_1 _RDC.Atom_isotope_number_1 _RDC.Ambiguity_code_1 _RDC.Assembly_atom_ID_2 _RDC.Entity_assembly_ID_2 _RDC.Entity_ID_2 _RDC.Comp_index_ID_2 _RDC.Seq_ID_2 _RDC.Comp_ID_2 _RDC.Atom_ID_2 _RDC.Atom_type_2 _RDC.Atom_isotope_number_2 _RDC.Ambiguity_code_2 _RDC.Val _RDC.Val_min _RDC.Val_max _RDC.Val_err _RDC.Val_bond_length _RDC.Resonance_ID_1 _RDC.Resonance_ID_2 _RDC.Auth_entity_assembly_ID_1 _RDC.Auth_seq_ID_1 _RDC.Auth_comp_ID_1 _RDC.Auth_atom_ID_1 _RDC.Auth_entity_assembly_ID_2 _RDC.Auth_seq_ID_2 _RDC.Auth_comp_ID_2 _RDC.Auth_atom_ID_2 _RDC.Entry_ID _RDC.RDC_list_ID 1 DHN . 1 1 2 2 ASP H H 1 . . 1 1 2 2 ASP N N 15 . 3.774 . . . . . . 1 2 ASP H 1 2 ASP N 16821 1 2 DHN . 1 1 4 4 GLU H H 1 . . 1 1 4 4 GLU N N 15 . -6.736 . . . . . . 1 4 GLU H 1 4 GLU N 16821 1 3 DHN . 1 1 7 7 PHE H H 1 . . 1 1 7 7 PHE N N 15 . -15.346 . . . . . . 1 7 PHE H 1 7 PHE N 16821 1 4 DHN . 1 1 8 8 THR H H 1 . . 1 1 8 8 THR N N 15 . -7.304 . . . . . . 1 8 THR H 1 8 THR N 16821 1 5 DHN . 1 1 9 9 ARG H H 1 . . 1 1 9 9 ARG N N 15 . 0.692 . . . . . . 1 9 ARG H 1 9 ARG N 16821 1 6 DHN . 1 1 12 12 LEU H H 1 . . 1 1 12 12 LEU N N 15 . -4.400 . . . . . . 1 12 LEU H 1 12 LEU N 16821 1 7 DHN . 1 1 13 13 ALA H H 1 . . 1 1 13 13 ALA N N 15 . -1.112 . . . . . . 1 13 ALA H 1 13 ALA N 16821 1 8 DHN . 1 1 14 14 GLN H H 1 . . 1 1 14 14 GLN N N 15 . -11.632 . . . . . . 1 14 GLN H 1 14 GLN N 16821 1 9 DHN . 1 1 16 16 HIS H H 1 . . 1 1 16 16 HIS N N 15 . -2.924 . . . . . . 1 16 HIS H 1 16 HIS N 16821 1 10 DHN . 1 1 17 17 LEU H H 1 . . 1 1 17 17 LEU N N 15 . -4.088 . . . . . . 1 17 LEU H 1 17 LEU N 16821 1 11 DHN . 1 1 19 19 HIS H H 1 . . 1 1 19 19 HIS N N 15 . -0.734 . . . . . . 1 19 HIS H 1 19 HIS N 16821 1 12 DHN . 1 1 20 20 ASP H H 1 . . 1 1 20 20 ASP N N 15 . 11.480 . . . . . . 1 20 ASP H 1 20 ASP N 16821 1 13 DHN . 1 1 22 22 ALA H H 1 . . 1 1 22 22 ALA N N 15 . -8.374 . . . . . . 1 22 ALA H 1 22 ALA N 16821 1 14 DHN . 1 1 23 23 SER H H 1 . . 1 1 23 23 SER N N 15 . 3.796 . . . . . . 1 23 SER H 1 23 SER N 16821 1 15 DHN . 1 1 24 24 ARG H H 1 . . 1 1 24 24 ARG N N 15 . 9.470 . . . . . . 1 24 ARG H 1 24 ARG N 16821 1 16 DHN . 1 1 25 25 ALA H H 1 . . 1 1 25 25 ALA N N 15 . -6.408 . . . . . . 1 25 ALA H 1 25 ALA N 16821 1 17 DHN . 1 1 26 26 LEU H H 1 . . 1 1 26 26 LEU N N 15 . 6.886 . . . . . . 1 26 LEU H 1 26 LEU N 16821 1 18 DHN . 1 1 27 27 ALA H H 1 . . 1 1 27 27 ALA N N 15 . 6.884 . . . . . . 1 27 ALA H 1 27 ALA N 16821 1 19 DHN . 1 1 28 28 LEU H H 1 . . 1 1 28 28 LEU N N 15 . 4.510 . . . . . . 1 28 LEU H 1 28 LEU N 16821 1 20 DHN . 1 1 29 29 PHE H H 1 . . 1 1 29 29 PHE N N 15 . -4.644 . . . . . . 1 29 PHE H 1 29 PHE N 16821 1 21 DHN . 1 1 30 30 GLU H H 1 . . 1 1 30 30 GLU N N 15 . 5.230 . . . . . . 1 30 GLU H 1 30 GLU N 16821 1 22 DHN . 1 1 31 31 GLU H H 1 . . 1 1 31 31 GLU N N 15 . 11.132 . . . . . . 1 31 GLU H 1 31 GLU N 16821 1 23 DHN . 1 1 33 33 VAL H H 1 . . 1 1 33 33 VAL N N 15 . -2.350 . . . . . . 1 33 VAL H 1 33 VAL N 16821 1 24 DHN . 1 1 34 34 GLU H H 1 . . 1 1 34 34 GLU N N 15 . 5.058 . . . . . . 1 34 GLU H 1 34 GLU N 16821 1 25 DHN . 1 1 35 35 THR H H 1 . . 1 1 35 35 THR N N 15 . 7.264 . . . . . . 1 35 THR H 1 35 THR N 16821 1 26 DHN . 1 1 36 36 ASP H H 1 . . 1 1 36 36 ASP N N 15 . -12.898 . . . . . . 1 36 ASP H 1 36 ASP N 16821 1 27 DHN . 1 1 38 38 ASP H H 1 . . 1 1 38 38 ASP N N 15 . -15.376 . . . . . . 1 38 ASP H 1 38 ASP N 16821 1 28 DHN . 1 1 39 39 TYR H H 1 . . 1 1 39 39 TYR N N 15 . 7.078 . . . . . . 1 39 TYR H 1 39 TYR N 16821 1 29 DHN . 1 1 40 40 VAL H H 1 . . 1 1 40 40 VAL N N 15 . -4.914 . . . . . . 1 40 VAL H 1 40 VAL N 16821 1 30 DHN . 1 1 41 41 GLY H H 1 . . 1 1 41 41 GLY N N 15 . -24.336 . . . . . . 1 41 GLY H 1 41 GLY N 16821 1 31 DHN . 1 1 42 42 THR H H 1 . . 1 1 42 42 THR N N 15 . -12.228 . . . . . . 1 42 THR H 1 42 THR N 16821 1 32 DHN . 1 1 43 43 TYR H H 1 . . 1 1 43 43 TYR N N 15 . -6.334 . . . . . . 1 43 TYR H 1 43 TYR N 16821 1 33 DHN . 1 1 44 44 TYR H H 1 . . 1 1 44 44 TYR N N 15 . -8.942 . . . . . . 1 44 TYR H 1 44 TYR N 16821 1 34 DHN . 1 1 45 45 HIS H H 1 . . 1 1 45 45 HIS N N 15 . -17.502 . . . . . . 1 45 HIS H 1 45 HIS N 16821 1 35 DHN . 1 1 47 47 GLY H H 1 . . 1 1 47 47 GLY N N 15 . -0.140 . . . . . . 1 47 GLY H 1 47 GLY N 16821 1 36 DHN . 1 1 49 49 LEU H H 1 . . 1 1 49 49 LEU N N 15 . -14.216 . . . . . . 1 49 LEU H 1 49 LEU N 16821 1 37 DHN . 1 1 50 50 TYR H H 1 . . 1 1 50 50 TYR N N 15 . -5.504 . . . . . . 1 50 TYR H 1 50 TYR N 16821 1 38 DHN . 1 1 53 53 LEU H H 1 . . 1 1 53 53 LEU N N 15 . -5.224 . . . . . . 1 53 LEU H 1 53 LEU N 16821 1 39 DHN . 1 1 54 54 ASP H H 1 . . 1 1 54 54 ASP N N 15 . 18.822 . . . . . . 1 54 ASP H 1 54 ASP N 16821 1 40 DHN . 1 1 55 55 ARG H H 1 . . 1 1 55 55 ARG N N 15 . 4.740 . . . . . . 1 55 ARG H 1 55 ARG N 16821 1 41 DHN . 1 1 56 56 THR H H 1 . . 1 1 56 56 THR N N 15 . -11.820 . . . . . . 1 56 THR H 1 56 THR N 16821 1 42 DHN . 1 1 57 57 ASP H H 1 . . 1 1 57 57 ASP N N 15 . 4.832 . . . . . . 1 57 ASP H 1 57 ASP N 16821 1 43 DHN . 1 1 58 58 ASP H H 1 . . 1 1 58 58 ASP N N 15 . 1.636 . . . . . . 1 58 ASP H 1 58 ASP N 16821 1 44 DHN . 1 1 59 59 ALA H H 1 . . 1 1 59 59 ALA N N 15 . -12.462 . . . . . . 1 59 ALA H 1 59 ALA N 16821 1 45 DHN . 1 1 60 60 ILE H H 1 . . 1 1 60 60 ILE N N 15 . -6.270 . . . . . . 1 60 ILE H 1 60 ILE N 16821 1 46 DHN . 1 1 63 63 TYR H H 1 . . 1 1 63 63 TYR N N 15 . -13.156 . . . . . . 1 63 TYR H 1 63 TYR N 16821 1 47 DHN . 1 1 64 64 ALA H H 1 . . 1 1 64 64 ALA N N 15 . -1.664 . . . . . . 1 64 ALA H 1 64 ALA N 16821 1 48 DHN . 1 1 66 66 GLY H H 1 . . 1 1 66 66 GLY N N 15 . -8.906 . . . . . . 1 66 GLY H 1 66 GLY N 16821 1 49 DHN . 1 1 67 67 ILE H H 1 . . 1 1 67 67 ILE N N 15 . -5.138 . . . . . . 1 67 ILE H 1 67 ILE N 16821 1 50 DHN . 1 1 68 68 GLU H H 1 . . 1 1 68 68 GLU N N 15 . 6.764 . . . . . . 1 68 GLU H 1 68 GLU N 16821 1 51 DHN . 1 1 69 69 VAL H H 1 . . 1 1 69 69 VAL N N 15 . -2.996 . . . . . . 1 69 VAL H 1 69 VAL N 16821 1 52 DHN . 1 1 70 70 ALA H H 1 . . 1 1 70 70 ALA N N 15 . -9.738 . . . . . . 1 70 ALA H 1 70 ALA N 16821 1 53 DHN . 1 1 71 71 ARG H H 1 . . 1 1 71 71 ARG N N 15 . 4.346 . . . . . . 1 71 ARG H 1 71 ARG N 16821 1 54 DHN . 1 1 73 73 GLU H H 1 . . 1 1 73 73 GLU N N 15 . -7.238 . . . . . . 1 73 GLU H 1 73 GLU N 16821 1 55 DHN . 1 1 74 74 GLY H H 1 . . 1 1 74 74 GLY N N 15 . -3.852 . . . . . . 1 74 GLY H 1 74 GLY N 16821 1 56 DHN . 1 1 75 75 THR H H 1 . . 1 1 75 75 THR N N 15 . 10.666 . . . . . . 1 75 THR H 1 75 THR N 16821 1 57 DHN . 1 1 78 78 ASP H H 1 . . 1 1 78 78 ASP N N 15 . -15.280 . . . . . . 1 78 ASP H 1 78 ASP N 16821 1 58 DHN . 1 1 79 79 LEU H H 1 . . 1 1 79 79 LEU N N 15 . -5.492 . . . . . . 1 79 LEU H 1 79 LEU N 16821 1 59 DHN . 1 1 80 80 SER H H 1 . . 1 1 80 80 SER N N 15 . -8.246 . . . . . . 1 80 SER H 1 80 SER N 16821 1 60 DHN . 1 1 83 83 GLN H H 1 . . 1 1 83 83 GLN N N 15 . -3.934 . . . . . . 1 83 GLN H 1 83 GLN N 16821 1 61 DHN . 1 1 85 85 ALA H H 1 . . 1 1 85 85 ALA N N 15 . -21.468 . . . . . . 1 85 ALA H 1 85 ALA N 16821 1 62 DHN . 1 1 86 86 LYS H H 1 . . 1 1 86 86 LYS N N 15 . -9.898 . . . . . . 1 86 LYS H 1 86 LYS N 16821 1 63 DHN . 1 1 87 87 LEU H H 1 . . 1 1 87 87 LEU N N 15 . -5.980 . . . . . . 1 87 LEU H 1 87 LEU N 16821 1 64 DHN . 1 1 88 88 LYS H H 1 . . 1 1 88 88 LYS N N 15 . -19.208 . . . . . . 1 88 LYS H 1 88 LYS N 16821 1 65 DHN . 1 1 89 89 ALA H H 1 . . 1 1 89 89 ALA N N 15 . -17.396 . . . . . . 1 89 ALA H 1 89 ALA N 16821 1 66 DHN . 1 1 90 90 GLU H H 1 . . 1 1 90 90 GLU N N 15 . -1.228 . . . . . . 1 90 GLU H 1 90 GLU N 16821 1 67 DHN . 1 1 91 91 GLY H H 1 . . 1 1 91 91 GLY N N 15 . -9.050 . . . . . . 1 91 GLY H 1 91 GLY N 16821 1 68 DHN . 1 1 92 92 LEU H H 1 . . 1 1 92 92 LEU N N 15 . -17.010 . . . . . . 1 92 LEU H 1 92 LEU N 16821 1 69 DHN . 1 1 93 93 GLU H H 1 . . 1 1 93 93 GLU N N 15 . 2.020 . . . . . . 1 93 GLU H 1 93 GLU N 16821 1 70 DHN . 1 1 95 95 HIS H H 1 . . 1 1 95 95 HIS N N 15 . 2.292 . . . . . . 1 95 HIS H 1 95 HIS N 16821 1 stop_ save_