NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)
image mrblock_id pdb_id bmrb_id cing stage program type
653890 7jk8 50411 cing 2-parsed STAR comment 

data_7jk8_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_7jk8 
    _Study_list.ID           1 

    loop_
        _Study.ID 
        _Study.Name 
        _Study.Type 
        _Study.Details 
        _Study.Entry_ID 
        _Study.Study_list_ID 

        1   "Conversion project"    NMR   .   parsed_7jk8   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_7jk8 
    _Entry.Title                       "Original constraint list(s)" 
    _Entry.Version_type                 original 
    _Entry.Submission_date              . 
    _Entry.Accession_date               . 
    _Entry.Last_release_date            . 
    _Entry.Original_release_date        . 
    _Entry.Origination                  . 
    _Entry.NMR_STAR_version             3.1 
    _Entry.Original_NMR_STAR_version    . 
    _Entry.Experimental_method          NMR 
    _Entry.Experimental_method_subtype  . 

    loop_
        _Related_entries.Database_name 
        _Related_entries.Database_accession_code 
        _Related_entries.Relationship 
        _Related_entries.Entry_ID 

        PDB   7jk8   "Master copy"    parsed_7jk8   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_7jk8 
    _Constraint_stat_list.ID           1 

    loop_
        _Constraint_file.ID 
        _Constraint_file.Constraint_filename 
        _Constraint_file.Software_ID 
        _Constraint_file.Software_label 
        _Constraint_file.Software_name 
        _Constraint_file.Block_ID 
        _Constraint_file.Constraint_type 
        _Constraint_file.Constraint_subtype 
        _Constraint_file.Constraint_subsubtype 
        _Constraint_file.Constraint_number 
        _Constraint_file.Entry_ID 
        _Constraint_file.Constraint_stat_list_ID 

        1   7jk8.mr   .   .   "MR format"    1    comment                  "Not applicable"    "Not applicable"    0   parsed_7jk8   1   
        1   7jk8.mr   .   .    XPLOR/CNS     2    distance                  NOE                 ambi               0   parsed_7jk8   1   
        1   7jk8.mr   .   .    unknown       3   "dihedral angle"          "Not applicable"    "Not applicable"    0   parsed_7jk8   1   
        1   7jk8.mr   .   .    XPLOR/CNS     4   "dihedral angle"          "Not applicable"    "Not applicable"    0   parsed_7jk8   1   
        1   7jk8.mr   .   .   "MR format"    5   "nomenclature mapping"    "Not applicable"    "Not applicable"    0   parsed_7jk8   1   
    stop_

save_


save_MR_file_comment_1
    _Org_constr_file_comment.Sf_category         org_constr_file_comment 
    _Org_constr_file_comment.Entry_ID            parsed_7jk8 
    _Org_constr_file_comment.ID                  1 
    _Org_constr_file_comment.Constraint_file_ID  1 
    _Org_constr_file_comment.Block_ID            1 
    _Org_constr_file_comment.Details            "Generated by Wattos" 
    _Org_constr_file_comment.Comment            
;
*HEADER    MEMBRANE PROTEIN                        27-JUL-20   7JK8              
*TITLE     EMRE S64V MUTANT BOUND TO TETRA(4-FLUOROPHENYL)PHOSPHONIUM AT PH 5.8  
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: MULTIDRUG SMR TRANSPORTER;                                 
*COMPND   3 CHAIN: A, B;                                                         
*COMPND   4 SYNONYM: MULTIDRUG RESISTANCE PROTEIN,MULTIDRUG TRANSPORTER EMRE,SMR 
*COMPND   5 FAMILY MULTIDRUG EFFLUX PROTEIN EMRE;                                
*COMPND   6 ENGINEERED: YES;                                                     
*COMPND   7 MUTATION: YES;                                                       
*COMPND   8 OTHER_DETAILS: ASYMMETRIC HOMODIMER - CHEMICAL SHIFT DATA FOR TWO    
*COMPND   9 CHAINS ARE DIFFERENT.                                                
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI;                               
*SOURCE   3 ORGANISM_TAXID: 562;                                                 
*SOURCE   4 GENE: EMRE, EMRE_2, BVCMSNSNP036_03582, D3821_21360, D9G11_17095,    
*SOURCE   5 EYY27_16395, NCTC12650_04038, SAMEA3752559_04448;                    
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3);                       
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 469008;                                     
*SOURCE   8 EXPRESSION_SYSTEM_PLASMID: PET15B                                    
*KEYWDS    SMALL MULTIDRUG RESISTANCE PROTEIN, ANTIPORTER, DRUG EFFLUX PUMP,     
*KEYWDS   2 MEMBRANE PROTEIN                                                     
*EXPDTA    SOLID-STATE NMR                                                       
*NUMMDL    10                                                                    
*AUTHOR    A.A.SHCHERBAKOV,G.HISAO,V.S.MANDALA,N.E.THOMAS,M.SOLTANI,E.A.SALTER,  
*AUTHOR   2 J.H.DAVIS JR.,K.A.HENZLER-WILDMAN,M.HONG                             
*REVDAT   1   09-DEC-20 7JK8    0                                                
;

save_

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