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
18198 2dj3 11109 cing 1-original MR format comment 

*HEADER    ISOMERASE                               30-MAR-06   2DJ3              
*TITLE     THE SOLUTION STRUCTURE OF THE THIRD THIOREDOXIN DOMAIN OF             
*TITLE    2 MOUSE PROTEIN DISULFIDE-ISOMERASE A4                                 
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: PROTEIN DISULFIDE-ISOMERASE A4;                            
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: 3RD THIOREDOXIN DOMAIN;                                    
*COMPND   5 SYNONYM: PROTEIN ERP-72, ERP72;                                      
*COMPND   6 EC: 5.3.4.1;                                                         
*COMPND   7 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: MUS MUSCULUS;                                   
*SOURCE   3 ORGANISM_COMMON: HOUSE MOUSE;                                        
*SOURCE   4 ORGANISM_TAXID: 10090;                                               
*SOURCE   5 GENE: PDIA4, CAI, ERP72;                                             
*SOURCE   6 EXPRESSION_SYSTEM: CELL FREE SYNTHESIS;                              
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   8 EXPRESSION_SYSTEM_PLASMID: P050425-15;                               
*SOURCE   9 OTHER_DETAILS: CELL-FREE PROTEIN SYNTHESIS                           
*KEYWDS    PROTEIN ERP-72, ERP72, CAI, STRUCTURAL GENOMICS, NPPSFA,              
*KEYWDS   2 NATIONAL PROJECT ON PROTEIN STRUCTURAL AND FUNCTIONAL                
*KEYWDS   3 ANALYSES, RIKEN STRUCTURAL GENOMICS/PROTEOMICS INITIATIVE,           
*KEYWDS   4 RSGI, ISOMERASE                                                      
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    N.TOCHIO, M.SATO, S.KOSHIBA, M.INOUE, T.KIGAWA, S.YOKOYAMA,           
*AUTHOR   2 RIKEN STRUCTURAL GENOMICS/PROTEOMICS INITIATIVE (RSGI)               
*REVDAT   1   12-MAY-09 2DJ3    0                                                

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During the CYANA calculations automatic implicit swapping of restraints 
involving diastereotopic substitutents was applied for prochrial groups 
without stereospecific assignment. Diastereotopic substitents were 
swapped individually in each conformer to calculate the minimal target 
function and restraint violations.
The optimal swapping for a given prochiral group may differ among 
the 20 conformers that represent the solution structure. The swapping 
is therefore performed implicitly in the program and is not reflected 
in the distance restraint file deposited in the PDB.
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