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
575235 2md9 19479 cing 2-parsed STAR comment 

data_2md9_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_2md9 
    _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_2md9   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_2md9 
    _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   2md9   "Master copy"    parsed_2md9   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_2md9 
    _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   2md9.mr   .   .   "MR format"    1    comment                  "Not applicable"    "Not applicable"    0   parsed_2md9   1   
        1   2md9.mr   .   .    DYANA/DIANA   2    distance                  NOE                 simple             0   parsed_2md9   1   
        1   2md9.mr   .   .    DYANA/DIANA   3   "dihedral angle"          "Not applicable"    "Not applicable"    0   parsed_2md9   1   
        1   2md9.mr   .   .   "MR format"    4   "nomenclature mapping"    "Not applicable"    "Not applicable"    0   parsed_2md9   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_2md9 
    _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    LIGASE                                  06-SEP-13   2MD9              
*TITLE     SOLUTION STRUCTURE OF AN ACTIVE SITE MUTANT PEPITDYL CARRIER PROTEIN  
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: TYROCIDINE SYNTHASE 3;                                     
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: THIRD PCP DOMAIN OF TYCC (UNP RESIDUES 3032-3113);         
*COMPND   5 SYNONYM: TYROCIDINE SYNTHASE III, ATP-DEPENDENT ASPARAGINE ADENYLASE,
*COMPND   6 ASNA, ASPARAGINE ACTIVASE, ATP-DEPENDENT GLUTAMINE ADENYLASE, GLNA,  
*COMPND   7 GLUTAMINE ACTIVASE, ATP-DEPENDENT TYROSINE ADENYLASE, TYRA, TYROSINE 
*COMPND   8 ACTIVASE, ATP-DEPENDENT VALINE ADENYLASE, VALA, VALINE ACTIVASE, ATP-
*COMPND   9 DEPENDENT ORNITHINE ADENYLASE, ORNA, ORNITHINE ACTIVASE, ATP-        
*COMPND  10 DEPENDENT LEUCINE ADENYLASE, LEUA, LEUCINE ACTIVASE;                 
*COMPND  11 ENGINEERED: YES;                                                     
*COMPND  12 MUTATION: YES                                                        
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: BREVIBACILLUS PARABREVIS;                       
*SOURCE   3 ORGANISM_TAXID: 54914;                                               
*SOURCE   4 STRAIN: ATCC 8185;                                                   
*SOURCE   5 GENE: TYCC;                                                          
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   8 EXPRESSION_SYSTEM_STRAIN: M15;                                       
*SOURCE   9 EXPRESSION_SYSTEM_VARIANT: PREP4;                                    
*SOURCE  10 EXPRESSION_SYSTEM_VECTOR: PQE70                                      
*KEYWDS    PROTEIN, CARRIER PROTEIN, LIGASE                                      
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    P.TUFAR, S.RAHIGHI, F.I.KRAAS, D.K.KIRCHNER, F.LOEHR, E.HENRICH,      
*AUTHOR   2 J.KOEPKE, I.DIKIC, P.GUENTERT, M.A.MARAHIEL, V.DOETSCH               
*REVDAT   1   23-APR-14 2MD9    0                                                


;

save_

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