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
19068 2ed1 11153 cing 1-original MR format comment


*HEADER    SIGNALING PROTEIN                       14-FEB-07   2ED1              
*TITLE     SOLUTION STRUCTURE OF THE SH3 DOMAIN OF 130 KDA                       
*TITLE    2 PHOSPHATIDYLINOSITOL 4,5-BIPHOSPHATE-DEPENDENT ARF1 GTPASE-          
*TITLE    3 ACTIVATING PROTEIN                                                   
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: 130 KDA PHOSPHATIDYLINOSITOL 4,5-BIPHOSPHATE-              
*COMPND   3 DEPENDENT ARF1 GTPASE-ACTIVATING PROTEIN;                            
*COMPND   4 CHAIN: A;                                                            
*COMPND   5 FRAGMENT: SH3 DOMAIN;                                                
*COMPND   6 SYNONYM: PIP2-DEPENDENT ARF1 GAP, ADP-RIBOSYLATION FACTOR-           
*COMPND   7 DIRECTED GTPASE-ACTIVATING PROTEIN 1, ARF GTPASE-                    
*COMPND   8 ACTIVATING PROTEIN 1, DEVELOPMENT AND DIFFERENTIATION-               
*COMPND   9 ENHANCING FACTOR 1;                                                  
*COMPND  10 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGANISM_TAXID: 9606;                                                
*SOURCE   5 GENE: DDEF1;                                                         
*SOURCE   6 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   7 EXPRESSION_SYSTEM_PLASMID: P050627-26;                               
*SOURCE   8 OTHER_DETAILS: CELL-FREE PROTEIN SYNTHESIS                           
*KEYWDS    GTPASE ACTIVATION, MEMBRANE, METAL-BINDING, SH3 DOMAIN,               
*KEYWDS   2 ZINC-FINGER, STRUCTURAL GENOMICS, NPPSFA, NATIONAL PROJECT           
*KEYWDS   3 ON PROTEIN STRUCTURAL AND FUNCTIONAL ANALYSES, RIKEN                 
*KEYWDS   4 STRUCTURAL GENOMICS/PROTEOMICS INITIATIVE, RSGI, SIGNALING           
*KEYWDS   5 PROTEIN                                                              
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    H.ABE, N.TOCHIO, K.MIYAMOTO, K.SAITO, T.KIGAWA, S.YOKOYAMA,           
*AUTHOR   2 RIKEN STRUCTURAL GENOMICS/PROTEOMICS INITIATIVE (RSGI)               
*REVDAT   1   12-MAY-09 2ED1    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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