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
29014 1afi cing recoord dress 2-parsed STAR comment 

data_1afi_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_1afi 
    _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_1afi   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_1afi 
    _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   1afi   "Master copy"    parsed_1afi   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_1afi 
    _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   1afi.mr   .   .   "MR format"    1    comment                  "Not applicable"    "Not applicable"    0   parsed_1afi   1   
        1   1afi.mr   .   .    XPLOR/CNS     2    distance                  NOE                 simple             0   parsed_1afi   1   
        1   1afi.mr   .   .    XPLOR/CNS     3    distance                 "hydrogen bond"      simple             0   parsed_1afi   1   
        1   1afi.mr   .   .    XPLOR/CNS     4   "dihedral angle"          "Not applicable"    "Not applicable"    0   parsed_1afi   1   
        1   1afi.mr   .   .   "MR format"    5   "nomenclature mapping"    "Not applicable"    "Not applicable"    0   parsed_1afi   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_1afi 
    _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   MERCURY DETOXIFICATION                  07-MAR-97   1AFI    
*TITLE    STRUCTURE OF THE REDUCED FORM OF MERP, THE PERIPLASMIC      
*TITLE   2 PROTEIN FROM THE BACTERIAL MERCURY DETOXIFICATION SYSTEM,  
*TITLE   3 NMR, 20 STRUCTURES                                         
*COMPND   MOL_ID: 1;                                                  
*COMPND  2 MOLECULE: MERP;                                            
*COMPND  3 CHAIN: NULL;                                               
*COMPND  4 SYNONYM: MERCURIC TRANSPORT PROTEIN;                       
*COMPND  5 ENGINEERED: MERP GENE AMPLIFIED USING PCR;                 
*COMPND  6 BIOLOGICAL_UNIT: MONOMER;                                  
*COMPND  7 OTHER_DETAILS: THE PROTEIN STUDIED EXCLUDES THE PRECURSOR  
*COMPND  8 SIGNAL SEQUENCE.  THIS IS THE NATIVE FORM OF THE PROTEIN   
*COMPND  9 AFTER CELL PROCESSING.                                     
*SOURCE   MOL_ID: 1;                                                  
*SOURCE  2 ORGANISM_SCIENTIFIC: SHIGELLA FLEXNERI;                    
*SOURCE  3 CELLULAR_LOCATION: PERIPLASM;                              
*SOURCE  4 PLASMID: R100 (NR1);                                       
*SOURCE  5 GENE: MERP;                                                
*SOURCE  6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                       
*SOURCE  7 EXPRESSION_SYSTEM_STRAIN: BL21;                            
*SOURCE  8 EXPRESSION_SYSTEM_VARIANT: DE3;                            
*SOURCE  9 EXPRESSION_SYSTEM_CELLULAR_LOCATION: CYTOPLASM;            
*SOURCE 10 EXPRESSION_SYSTEM_VECTOR_TYPE: MALTOSE BINDING PROTEIN     
*SOURCE 11 FUSION SYSTEM;                                             
*SOURCE 12 EXPRESSION_SYSTEM_VECTOR: MALTOSE BINDING PROTEIN FUSION   
*SOURCE 13 PROTEIN (PMAL-C2);                                         
*SOURCE 14 EXPRESSION_SYSTEM_PLASMID: PSSS;                           
*SOURCE 15 EXPRESSION_SYSTEM_GENE: MERP;                              
*SOURCE 16 OTHER_DETAILS: MER GENES LOCATED ON TRANSPOSON TN21        
*KEYWDS   MERCURY DETOXIFICATION, PERIPLASMIC, HEAVY METAL TRANSPORT, 
*KEYWDS  2 ALPHA-BETA SANDWICH                                        
*EXPDTA   NMR, 20 STRUCTURES                                          
*AUTHOR   R.A.STEELE,S.J.OPELLA                                       
*REVDAT  1   23-JUL-97 1AFI    0                                      


;

save_

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