NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)
image mrblock_id pdb_id cing in_recoord in_dress stage program type
28840 1a57 cing recoord dress 2-parsed STAR comment 

data_1a57_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_1a57 
    _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_1a57   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_1a57 
    _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   1a57   "Master copy"    parsed_1a57   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_1a57 
    _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   1a57.mr   .   .   "MR format"    1    comment                  "Not applicable"    "Not applicable"    0   parsed_1a57   1   
        1   1a57.mr   .   .    XPLOR/CNS     2    distance                  NOE                 simple             0   parsed_1a57   1   
        1   1a57.mr   .   .   "MR format"    3   "nomenclature mapping"    "Not applicable"    "Not applicable"    0   parsed_1a57   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_1a57 
    _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   FATTY ACID-BINDING                      20-FEB-98   1A57    
*TITLE    THE THREE-DIMENSIONAL STRUCTURE OF A HELIX-LESS VARIANT OF  
*TITLE   2 INTESTINAL FATTY ACID BINDING PROTEIN, NMR, 20 STRUCTURES  
*COMPND   MOL_ID: 1;                                                  
*COMPND  2 MOLECULE: INTESTINAL FATTY ACID-BINDING PROTEIN;           
*COMPND  3 CHAIN: NULL;                                               
*COMPND  4 SYNONYM: DELTA17SG, IFABP, I-FABP;                         
*COMPND  5 ENGINEERED: YES;                                           
*COMPND  6 OTHER_DETAILS: HELIX-LESS, COMPLEXED WITH PALMITATE        
*SOURCE   MOL_ID: 1;                                                  
*SOURCE  2 ORGANISM_SCIENTIFIC: RATTUS NORVEGICUS;                    
*SOURCE  3 ORGANISM_COMMON: RAT;                                      
*SOURCE  4 CELL: SMALL INTESTINAL ENTEROCYTE;                         
*SOURCE  5 CELLULAR_LOCATION: CYTOPLASM;                              
*SOURCE  6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                       
*SOURCE  7 EXPRESSION_SYSTEM_STRAIN: MG1655;                          
*SOURCE  8 EXPRESSION_SYSTEM_CELLULAR_LOCATION: CYTOPLASM;            
*SOURCE  9 EXPRESSION_SYSTEM_PLASMID: PMON5840-IFABP(DELTA17SG);      
*SOURCE 10 OTHER_DETAILS: SEE REMARK 1, REFERENCE 3                   
*KEYWDS   FATTY ACID-BINDING, LIPID TRANSPORT, BETA-CLAM, LIPOCALINS  
*EXPDTA   NMR, 20 STRUCTURES                                          
*AUTHOR   R.A.STEELE,D.A.EMMERT,J.KAO,M.E.HODSDON,C.FRIEDEN,          
*AUTHOR  2 D.P.CISTOLA                                                
*REVDAT  1   27-MAY-98 1A57    0                                      
 
!Constraints file for helix-less I-FABP.
!
!Comments:  This XPLOR format version of the NMR constraints is provided
!for your convenience.  It was generated using a script.  The actual constraints
!format (key file) used for  calculations by the TINKER program has 
!also been provided to the PDB. The default target distance of 4.9 angstroms 
!was chosen arbitrarily and is meaningless.

;

save_

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