data_1624 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 1624 _Entry.Title ; Secondary structure of the phosphocarrier protein III(Glc), a signal-transducing protein from Escherichia coli, determined by heteronuclear three-dimensional NMR spectroscopy ; _Entry.Type macromolecule _Entry.Version_type update _Entry.Submission_date 1995-07-31 _Entry.Accession_date 1996-04-13 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination BMRB _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 2.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 J. Pelton . G. . 1624 2 Dennis Torchia . A. . 1624 3 Norman Meadow . D. . 1624 4 Cing-Yuen Wong . . . 1624 5 Saul Roseman . . . 1624 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 1624 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '1H chemical shifts' 13 1624 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 5 . . 2010-06-15 . revision BMRB 'Complete natural source information' 1624 4 . . 1999-06-14 . revision BMRB 'Converted to BMRB NMR-STAR V 2.1 format' 1624 3 . . 1996-04-13 . revision BMRB 'Link to the Protein Data Bank added' 1624 2 . . 1996-03-25 . reformat BMRB 'Converted to the BMRB 1996-03-01 STAR flat-file format' 1624 1 . . 1995-07-31 . original BMRB 'Last release in original BMRB flat-file format' 1624 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 1624 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation ; Pelton, J.G., Torchia, Dennis A., Meadow, Norman D., Wong, Cing-Yuen, Roseman, Saul, "Secondary structure of the phosphocarrier protein III(Glc), a signal-transducing protein from Escherichia coli, determined by heteronuclear three-dimensional NMR spectroscopy," Proc. Natl. Acad. Sci. U.S.A. 88, 3479-3483 (1991). ; _Citation.Title ; Secondary structure of the phosphocarrier protein III(Glc), a signal-transducing protein from Escherichia coli, determined by heteronuclear three-dimensional NMR spectroscopy ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Proc. Natl. Acad. Sci. U.S.A.' _Citation.Journal_name_full . _Citation.Journal_volume 88 _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 3479 _Citation.Page_last 3483 _Citation.Year 1991 _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 J. Pelton . G. . 1624 1 2 Dennis Torchia . A. . 1624 1 3 Norman Meadow . D. . 1624 1 4 Cing-Yuen Wong . . . 1624 1 5 Saul Roseman . . . 1624 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_system_glucose_permease _Assembly.Sf_category assembly _Assembly.Sf_framecode system_glucose_permease _Assembly.Entry_ID 1624 _Assembly.ID 1 _Assembly.Name 'glucose permease' _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 . _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 'glucose permease' 1 $glucose_permease . . . . . . . . . 1624 1 stop_ loop_ _Assembly_common_name.Name _Assembly_common_name.Type _Assembly_common_name.Entry_ID _Assembly_common_name.Assembly_ID 'glucose permease' system 1624 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_glucose_permease _Entity.Sf_category entity _Entity.Sf_framecode glucose_permease _Entity.Entry_ID 1624 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'glucose permease' _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 ; GLFDKLKSLVSDDKKDTGTI EIIAPLSGEIVNIEDVPDVV FAEKIVGDGIAIKPTGNKMV APVDGTIGKIFETNHAFSIE SDSGVELFVHFGIDTVELKG EGFKRIAEEGQRVKVGDTVI EFDLPLLEEKAKSTLTPVVI SNMDEIKELIKLSGSVTVGE TPVIRIKK ; _Entity.Polymer_seq_one_letter_code ; GLFDKLKSLVSDDKKDTGTI EIIAPLSGEIVNIEDVPDVV FAEKIVGDGIAIKPTGNKMV APVDGTIGKIFETNHAFSIE SDSGVELFVHFGIDTVELKG EGFKRIAEEGQRVKVGDTVI EFDLPLLEEKAKSTLTPVVI SNMDEIKELIKLSGSVTVGE TPVIRIKK ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 168 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state . _Entity.Src_method . _Entity.Parent_entity_ID 1 _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 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 PDB 1F3G . "Three-Dimensional Structure Of The Escherichia Coli Phosphocarrier Protein Iii Glc" . . . . . 95.83 161 100.00 100.00 4.29e-104 . . . . 1624 1 2 no PDB 1F3Z . "Iiaglc-Zn Complex" . . . . . 95.83 161 100.00 100.00 4.29e-104 . . . . 1624 1 3 no PDB 1GGR . "Complex Of Enzyme Iiaglc And The Histidine-Containing Phosphocarrier Protein Hpr From Escherichia Coli Nmr, Restrained Regulari" . . . . . 100.00 168 100.00 100.00 2.70e-109 . . . . 1624 1 4 no PDB 1GLA . "Structure Of The Regulatory Complex Of Escherichia Coli Iiiglc With Glycerol Kinase" . . . . . 100.00 168 100.00 100.00 2.70e-109 . . . . 1624 1 5 no PDB 1GLB . "Structure Of The Regulatory Complex Of Escherichia Coli Iiiglc With Glycerol Kinase" . . . . . 100.00 168 100.00 100.00 2.70e-109 . . . . 1624 1 6 no PDB 1GLC . "Cation Promoted Association (Cpa) Of A Regulatory And Target Protein Is Controlled By Phosphorylation" . . . . . 100.00 168 100.00 100.00 2.70e-109 . . . . 1624 1 7 no PDB 1GLD . "Cation Promoted Association (Cpa) Of A Regulatory And Target Protein Is Controlled By Phosphorylation" . . . . . 100.00 168 100.00 100.00 2.70e-109 . . . . 1624 1 8 no PDB 1GLE . "Cation Promoted Association (Cpa) Of A Regulatory And Target Protein Is Controlled By Phosphorylation" . . . . . 100.00 168 100.00 100.00 2.70e-109 . . . . 1624 1 9 no PDB 1O2F . "Complex Of Enzyme Iiaglc And Iibglc Phosphocarrier Protein Hpr From Escherichia Coli Nmr, Restrained Regularized Mean Structure" . . . . . 100.00 168 100.00 100.00 2.70e-109 . . . . 1624 1 10 no PDB 2F3G . "Iiaglc Crystal Form Iii" . . . . . 100.00 168 100.00 100.00 2.70e-109 . . . . 1624 1 11 no PDB 2MP0 . "Protein Phosphorylation Upon A Fleeting Encounter" . . . . . 100.00 168 100.00 100.00 2.70e-109 . . . . 1624 1 12 no PDB 4JBW . "Crystal Structure Of E. Coli Maltose Transporter Malfgk2 In Complex With Its Regulatory Protein Eiiaglc" . . . . . 100.00 172 100.00 100.00 1.37e-109 . . . . 1624 1 13 no DBJ BAA16291 . "glucose-specific enzyme IIA component of PTS [Escherichia coli str. K12 substr. W3110]" . . . . . 100.00 169 100.00 100.00 2.51e-109 . . . . 1624 1 14 no DBJ BAB36712 . "glucose-specific PTS system IIA component [Escherichia coli O157:H7 str. Sakai]" . . . . . 100.00 169 99.40 99.40 1.25e-108 . . . . 1624 1 15 no DBJ BAG78232 . "PTS system glucose-specific IIA component [Escherichia coli SE11]" . . . . . 100.00 169 100.00 100.00 2.51e-109 . . . . 1624 1 16 no DBJ BAH64558 . "glucose-specific PTS family enzyme IIA component [Klebsiella pneumoniae subsp. pneumoniae NTUH-K2044]" . . . . . 100.00 169 98.21 99.40 7.49e-108 . . . . 1624 1 17 no DBJ BAI26670 . "glucose-specific enzyme IIA component protein component of PTS [Escherichia coli O26:H11 str. 11368]" . . . . . 100.00 169 100.00 100.00 2.51e-109 . . . . 1624 1 18 no EMBL CAA28837 . "unnamed protein product [Salmonella enterica subsp. enterica serovar Typhimurium]" . . . . . 100.00 169 98.21 99.40 7.49e-108 . . . . 1624 1 19 no EMBL CAD07665 . "pts system, glucose-specific IIA component [Salmonella enterica subsp. enterica serovar Typhi str. CT18]" . . . . . 100.00 169 98.21 99.40 7.49e-108 . . . . 1624 1 20 no EMBL CAP76889 . "glucose-specific phosphotransferase enzyme IIA component [Escherichia coli LF82]" . . . . . 100.00 169 100.00 100.00 2.51e-109 . . . . 1624 1 21 no EMBL CAQ32795 . "crr, subunit of enzyme II [glc], trehalose PTS permease, EIIBCMalX and N-acetylmuramic acid PTS permease [Escherichia coli BL21" . . . . . 100.00 169 100.00 100.00 2.51e-109 . . . . 1624 1 22 no EMBL CAQ88295 . "glucose-specific enzyme IIA component of PTS [Escherichia fergusonii ATCC 35469]" . . . . . 100.00 169 100.00 100.00 2.51e-109 . . . . 1624 1 23 no GB AAA23602 . "PTS enzyme III glc [Escherichia coli]" . . . . . 100.00 169 100.00 100.00 2.51e-109 . . . . 1624 1 24 no GB AAA23603 . "PTS enzyme III glc [Escherichia coli]" . . . . . 100.00 169 100.00 100.00 2.51e-109 . . . . 1624 1 25 no GB AAA23604 . "PTS enzyme III glc [Escherichia coli]" . . . . . 100.00 169 100.00 100.00 2.51e-109 . . . . 1624 1 26 no GB AAA23605 . "PTS enzyme III glc [Escherichia coli]" . . . . . 100.00 169 100.00 100.00 2.51e-109 . . . . 1624 1 27 no GB AAA23606 . "PTS enzyme III glc [Escherichia coli]" . . . . . 100.00 169 100.00 100.00 2.51e-109 . . . . 1624 1 28 no PIR AG0810 . "pts system, glucose-specific IIA component [imported] - Salmonella enterica subsp. enterica serovar Typhi (strain CT18)" . . . . . 100.00 169 98.21 99.40 7.49e-108 . . . . 1624 1 29 no REF NP_311316 . "PTS system glucose-specific transporter [Escherichia coli O157:H7 str. Sakai]" . . . . . 100.00 169 99.40 99.40 1.25e-108 . . . . 1624 1 30 no REF NP_416912 . "glucose-specific enzyme IIA component of PTS [Escherichia coli str. K-12 substr. MG1655]" . . . . . 100.00 169 100.00 100.00 2.51e-109 . . . . 1624 1 31 no REF NP_456969 . "PTS system glucose-specific transporter subunit IIA [Salmonella enterica subsp. enterica serovar Typhi str. CT18]" . . . . . 100.00 169 98.21 99.40 7.49e-108 . . . . 1624 1 32 no REF NP_461368 . "PTS system glucose-specific transporter subunit IIA [Salmonella enterica subsp. enterica serovar Typhimurium str. LT2]" . . . . . 100.00 169 98.21 99.40 7.49e-108 . . . . 1624 1 33 no REF NP_708272 . "PTS system glucose-specific transporter subunit IIA [Shigella flexneri 2a str. 301]" . . . . . 100.00 169 100.00 100.00 2.51e-109 . . . . 1624 1 34 no SP P0A283 . "RecName: Full=Glucose-specific phosphotransferase enzyme IIA component; AltName: Full=EIIA-Glc; AltName: Full=EIII-Glc; AltName" . . . . . 100.00 169 98.21 99.40 7.49e-108 . . . . 1624 1 35 no SP P0A284 . "RecName: Full=Glucose-specific phosphotransferase enzyme IIA component; AltName: Full=EIIA-Glc; AltName: Full=EIII-Glc; AltName" . . . . . 100.00 169 98.21 99.40 7.49e-108 . . . . 1624 1 36 no SP P69783 . "RecName: Full=Glucose-specific phosphotransferase enzyme IIA component; AltName: Full=EIIA-Glc; AltName: Full=EIII-Glc; AltName" . . . . . 100.00 169 100.00 100.00 2.51e-109 . . . . 1624 1 37 no SP P69784 . "RecName: Full=Glucose-specific phosphotransferase enzyme IIA component; AltName: Full=EIIA-Glc; AltName: Full=EIII-Glc; AltName" . . . . . 100.00 169 100.00 100.00 2.51e-109 . . . . 1624 1 38 no SP P69785 . "RecName: Full=Glucose-specific phosphotransferase enzyme IIA component; AltName: Full=EIIA-Glc; AltName: Full=EIII-Glc; AltName" . . . . . 100.00 169 100.00 100.00 2.51e-109 . . . . 1624 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'enzyme IIIGlc' variant 1624 1 'glucose permease' common 1624 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 . GLY . 1624 1 2 . LEU . 1624 1 3 . PHE . 1624 1 4 . ASP . 1624 1 5 . LYS . 1624 1 6 . LEU . 1624 1 7 . LYS . 1624 1 8 . SER . 1624 1 9 . LEU . 1624 1 10 . VAL . 1624 1 11 . SER . 1624 1 12 . ASP . 1624 1 13 . ASP . 1624 1 14 . LYS . 1624 1 15 . LYS . 1624 1 16 . ASP . 1624 1 17 . THR . 1624 1 18 . GLY . 1624 1 19 . THR . 1624 1 20 . ILE . 1624 1 21 . GLU . 1624 1 22 . ILE . 1624 1 23 . ILE . 1624 1 24 . ALA . 1624 1 25 . PRO . 1624 1 26 . LEU . 1624 1 27 . SER . 1624 1 28 . GLY . 1624 1 29 . GLU . 1624 1 30 . ILE . 1624 1 31 . VAL . 1624 1 32 . ASN . 1624 1 33 . ILE . 1624 1 34 . GLU . 1624 1 35 . ASP . 1624 1 36 . VAL . 1624 1 37 . PRO . 1624 1 38 . ASP . 1624 1 39 . VAL . 1624 1 40 . VAL . 1624 1 41 . PHE . 1624 1 42 . ALA . 1624 1 43 . GLU . 1624 1 44 . LYS . 1624 1 45 . ILE . 1624 1 46 . VAL . 1624 1 47 . GLY . 1624 1 48 . ASP . 1624 1 49 . GLY . 1624 1 50 . ILE . 1624 1 51 . ALA . 1624 1 52 . ILE . 1624 1 53 . LYS . 1624 1 54 . PRO . 1624 1 55 . THR . 1624 1 56 . GLY . 1624 1 57 . ASN . 1624 1 58 . LYS . 1624 1 59 . MET . 1624 1 60 . VAL . 1624 1 61 . ALA . 1624 1 62 . PRO . 1624 1 63 . VAL . 1624 1 64 . ASP . 1624 1 65 . GLY . 1624 1 66 . THR . 1624 1 67 . ILE . 1624 1 68 . GLY . 1624 1 69 . LYS . 1624 1 70 . ILE . 1624 1 71 . PHE . 1624 1 72 . GLU . 1624 1 73 . THR . 1624 1 74 . ASN . 1624 1 75 . HIS . 1624 1 76 . ALA . 1624 1 77 . PHE . 1624 1 78 . SER . 1624 1 79 . ILE . 1624 1 80 . GLU . 1624 1 81 . SER . 1624 1 82 . ASP . 1624 1 83 . SER . 1624 1 84 . GLY . 1624 1 85 . VAL . 1624 1 86 . GLU . 1624 1 87 . LEU . 1624 1 88 . PHE . 1624 1 89 . VAL . 1624 1 90 . HIS . 1624 1 91 . PHE . 1624 1 92 . GLY . 1624 1 93 . ILE . 1624 1 94 . ASP . 1624 1 95 . THR . 1624 1 96 . VAL . 1624 1 97 . GLU . 1624 1 98 . LEU . 1624 1 99 . LYS . 1624 1 100 . GLY . 1624 1 101 . GLU . 1624 1 102 . GLY . 1624 1 103 . PHE . 1624 1 104 . LYS . 1624 1 105 . ARG . 1624 1 106 . ILE . 1624 1 107 . ALA . 1624 1 108 . GLU . 1624 1 109 . GLU . 1624 1 110 . GLY . 1624 1 111 . GLN . 1624 1 112 . ARG . 1624 1 113 . VAL . 1624 1 114 . LYS . 1624 1 115 . VAL . 1624 1 116 . GLY . 1624 1 117 . ASP . 1624 1 118 . THR . 1624 1 119 . VAL . 1624 1 120 . ILE . 1624 1 121 . GLU . 1624 1 122 . PHE . 1624 1 123 . ASP . 1624 1 124 . LEU . 1624 1 125 . PRO . 1624 1 126 . LEU . 1624 1 127 . LEU . 1624 1 128 . GLU . 1624 1 129 . GLU . 1624 1 130 . LYS . 1624 1 131 . ALA . 1624 1 132 . LYS . 1624 1 133 . SER . 1624 1 134 . THR . 1624 1 135 . LEU . 1624 1 136 . THR . 1624 1 137 . PRO . 1624 1 138 . VAL . 1624 1 139 . VAL . 1624 1 140 . ILE . 1624 1 141 . SER . 1624 1 142 . ASN . 1624 1 143 . MET . 1624 1 144 . ASP . 1624 1 145 . GLU . 1624 1 146 . ILE . 1624 1 147 . LYS . 1624 1 148 . GLU . 1624 1 149 . LEU . 1624 1 150 . ILE . 1624 1 151 . LYS . 1624 1 152 . LEU . 1624 1 153 . SER . 1624 1 154 . GLY . 1624 1 155 . SER . 1624 1 156 . VAL . 1624 1 157 . THR . 1624 1 158 . VAL . 1624 1 159 . GLY . 1624 1 160 . GLU . 1624 1 161 . THR . 1624 1 162 . PRO . 1624 1 163 . VAL . 1624 1 164 . ILE . 1624 1 165 . ARG . 1624 1 166 . ILE . 1624 1 167 . LYS . 1624 1 168 . LYS . 1624 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 . GLY 1 1 1624 1 . LEU 2 2 1624 1 . PHE 3 3 1624 1 . ASP 4 4 1624 1 . LYS 5 5 1624 1 . LEU 6 6 1624 1 . LYS 7 7 1624 1 . SER 8 8 1624 1 . LEU 9 9 1624 1 . VAL 10 10 1624 1 . SER 11 11 1624 1 . ASP 12 12 1624 1 . ASP 13 13 1624 1 . LYS 14 14 1624 1 . LYS 15 15 1624 1 . ASP 16 16 1624 1 . THR 17 17 1624 1 . GLY 18 18 1624 1 . THR 19 19 1624 1 . ILE 20 20 1624 1 . GLU 21 21 1624 1 . ILE 22 22 1624 1 . ILE 23 23 1624 1 . ALA 24 24 1624 1 . PRO 25 25 1624 1 . LEU 26 26 1624 1 . SER 27 27 1624 1 . GLY 28 28 1624 1 . GLU 29 29 1624 1 . ILE 30 30 1624 1 . VAL 31 31 1624 1 . ASN 32 32 1624 1 . ILE 33 33 1624 1 . GLU 34 34 1624 1 . ASP 35 35 1624 1 . VAL 36 36 1624 1 . PRO 37 37 1624 1 . ASP 38 38 1624 1 . VAL 39 39 1624 1 . VAL 40 40 1624 1 . PHE 41 41 1624 1 . ALA 42 42 1624 1 . GLU 43 43 1624 1 . LYS 44 44 1624 1 . ILE 45 45 1624 1 . VAL 46 46 1624 1 . GLY 47 47 1624 1 . ASP 48 48 1624 1 . GLY 49 49 1624 1 . ILE 50 50 1624 1 . ALA 51 51 1624 1 . ILE 52 52 1624 1 . LYS 53 53 1624 1 . PRO 54 54 1624 1 . THR 55 55 1624 1 . GLY 56 56 1624 1 . ASN 57 57 1624 1 . LYS 58 58 1624 1 . MET 59 59 1624 1 . VAL 60 60 1624 1 . ALA 61 61 1624 1 . PRO 62 62 1624 1 . VAL 63 63 1624 1 . ASP 64 64 1624 1 . GLY 65 65 1624 1 . THR 66 66 1624 1 . ILE 67 67 1624 1 . GLY 68 68 1624 1 . LYS 69 69 1624 1 . ILE 70 70 1624 1 . PHE 71 71 1624 1 . GLU 72 72 1624 1 . THR 73 73 1624 1 . ASN 74 74 1624 1 . HIS 75 75 1624 1 . ALA 76 76 1624 1 . PHE 77 77 1624 1 . SER 78 78 1624 1 . ILE 79 79 1624 1 . GLU 80 80 1624 1 . SER 81 81 1624 1 . ASP 82 82 1624 1 . SER 83 83 1624 1 . GLY 84 84 1624 1 . VAL 85 85 1624 1 . GLU 86 86 1624 1 . LEU 87 87 1624 1 . PHE 88 88 1624 1 . VAL 89 89 1624 1 . HIS 90 90 1624 1 . PHE 91 91 1624 1 . GLY 92 92 1624 1 . ILE 93 93 1624 1 . ASP 94 94 1624 1 . THR 95 95 1624 1 . VAL 96 96 1624 1 . GLU 97 97 1624 1 . LEU 98 98 1624 1 . LYS 99 99 1624 1 . GLY 100 100 1624 1 . GLU 101 101 1624 1 . GLY 102 102 1624 1 . PHE 103 103 1624 1 . LYS 104 104 1624 1 . ARG 105 105 1624 1 . ILE 106 106 1624 1 . ALA 107 107 1624 1 . GLU 108 108 1624 1 . GLU 109 109 1624 1 . GLY 110 110 1624 1 . GLN 111 111 1624 1 . ARG 112 112 1624 1 . VAL 113 113 1624 1 . LYS 114 114 1624 1 . VAL 115 115 1624 1 . GLY 116 116 1624 1 . ASP 117 117 1624 1 . THR 118 118 1624 1 . VAL 119 119 1624 1 . ILE 120 120 1624 1 . GLU 121 121 1624 1 . PHE 122 122 1624 1 . ASP 123 123 1624 1 . LEU 124 124 1624 1 . PRO 125 125 1624 1 . LEU 126 126 1624 1 . LEU 127 127 1624 1 . GLU 128 128 1624 1 . GLU 129 129 1624 1 . LYS 130 130 1624 1 . ALA 131 131 1624 1 . LYS 132 132 1624 1 . SER 133 133 1624 1 . THR 134 134 1624 1 . LEU 135 135 1624 1 . THR 136 136 1624 1 . PRO 137 137 1624 1 . VAL 138 138 1624 1 . VAL 139 139 1624 1 . ILE 140 140 1624 1 . SER 141 141 1624 1 . ASN 142 142 1624 1 . MET 143 143 1624 1 . ASP 144 144 1624 1 . GLU 145 145 1624 1 . ILE 146 146 1624 1 . LYS 147 147 1624 1 . GLU 148 148 1624 1 . LEU 149 149 1624 1 . ILE 150 150 1624 1 . LYS 151 151 1624 1 . LEU 152 152 1624 1 . SER 153 153 1624 1 . GLY 154 154 1624 1 . SER 155 155 1624 1 . VAL 156 156 1624 1 . THR 157 157 1624 1 . VAL 158 158 1624 1 . GLY 159 159 1624 1 . GLU 160 160 1624 1 . THR 161 161 1624 1 . PRO 162 162 1624 1 . VAL 163 163 1624 1 . ILE 164 164 1624 1 . ARG 165 165 1624 1 . ILE 166 166 1624 1 . LYS 167 167 1624 1 . LYS 168 168 1624 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 1624 _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 $glucose_permease . 562 organism . 'Escherichia coli' 'E. coli' . . Bacteria . Escherichia coli generic . . . . . . . . . . . . . . . . . . . . 1624 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 1624 _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 $glucose_permease . 'not available' 'Escherichia coli' . . . Escherichia coli BL21-(DE3) . . . . . . . . . . . . . . . . . . . . . . 1624 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_one _Sample.Sf_category sample _Sample.Sf_framecode sample_one _Sample.Entry_ID 1624 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _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 . save_ ####################### # Sample conditions # ####################### save_sample_condition_set_one _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_condition_set_one _Sample_condition_list.Entry_ID 1624 _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 6.4 . na 1624 1 temperature 309 . K 1624 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_list _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_list _NMR_spectrometer.Entry_ID 1624 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details 'spectrometer information not available' _NMR_spectrometer.Manufacturer unknown _NMR_spectrometer.Model unknown _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 0 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 1624 _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 unknown unknown . 0 'spectrometer information not available' . . 1624 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 1624 _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 . . . . . . . . . . . . 1 $sample_one . . . 1 $sample_condition_set_one . . . 1 $spectrometer_list . . . . . . . . . . . . . . . . 1624 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_par_set_one _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_par_set_one _Chem_shift_reference.Entry_ID 1624 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID H . H2O/HDO . . . . . ppm 4.67 . . . . . . 1 $entry_citation . . 1 $entry_citation 1624 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_chemical_shift_assignment_data_set_one _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode 'chemical_shift_assignment_data_set_one' _Assigned_chem_shift_list.Entry_ID 1624 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_condition_set_one _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_par_set_one _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 $sample_one . 1624 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 53 53 LYS HA H 1 4.7 . . 1 . . . . . . . . 1624 1 2 . 1 1 79 79 ILE H H 1 9.02 . . 1 . . . . . . . . 1624 1 3 . 1 1 80 80 GLU HA H 1 5.12 . . 1 . . . . . . . . 1624 1 4 . 1 1 86 86 GLU HA H 1 5.1 . . 1 . . . . . . . . 1624 1 5 . 1 1 87 87 LEU H H 1 8.99 . . 1 . . . . . . . . 1624 1 6 . 1 1 89 89 VAL HA H 1 4.37 . . 1 . . . . . . . . 1624 1 7 . 1 1 90 90 HIS HA H 1 4.33 . . 1 . . . . . . . . 1624 1 8 . 1 1 138 138 VAL HA H 1 4.33 . . 1 . . . . . . . . 1624 1 9 . 1 1 143 143 MET HA H 1 4.43 . . 1 . . . . . . . . 1624 1 10 . 1 1 144 144 ASP HA H 1 4.48 . . 1 . . . . . . . . 1624 1 11 . 1 1 145 145 GLU HA H 1 4.44 . . 1 . . . . . . . . 1624 1 12 . 1 1 146 146 ILE HA H 1 4.42 . . 1 . . . . . . . . 1624 1 13 . 1 1 147 147 LYS HA H 1 4.48 . . 1 . . . . . . . . 1624 1 stop_ save_