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Database: PDB
Entry: 1WFV
LinkDB: 1WFV
Original site: 1WFV 
HEADER    SIGNALING PROTEIN                       27-MAY-04   1WFV              
TITLE     SOLUTION STRUCTURE OF THE FIFTH PDZ DOMAIN OF HUMAN                   
TITLE    2 MEMBRANE ASSOCIATED GUANYLATE KINASE INVERTED-2 (KIAA0705            
TITLE    3 PROTEIN)                                                             
COMPND    MOL_ID: 1;                                                            
COMPND   2 MOLECULE: MEMBRANE ASSOCIATED GUANYLATE KINASE INVERTED-2;           
COMPND   3 CHAIN: A;                                                            
COMPND   4 FRAGMENT: PDZ DOMAIN;                                                
COMPND   5 SYNONYM: KIAA0705 PROTEIN, ATROPHIN-1 INTERACTING PROTEIN            
COMPND   6 1, MAGI-2;                                                           
COMPND   7 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: KAZUSA CDNA HG03359;                                           
SOURCE   6 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
SOURCE   7 EXPRESSION_SYSTEM_PLASMID: P021030-33;                               
SOURCE   8 OTHER_DETAILS: CELL-FREE PROTEIN SYNTHESIS                           
KEYWDS    ATROPHIN-1 INTERACTING PROTEIN 1, ACTIVIN RECEPTOR                    
KEYWDS   2 INTERACTING PROTEIN 1, MEMBRANE ASSOCIATED GUANYLATE KINASE          
KEYWDS   3 INVERTED-2, ACTIVIN TYPE IIA RECEPTOR, AIP1, ARIP1, ACVRIP1,         
KEYWDS   4 ACTRIIA, MAGI-2, PDZ DOMAIN, STRUCTURAL GENOMICS, RIKEN              
KEYWDS   5 STRUCTURAL GENOMICS/PROTEOMICS INITIATIVE, RSGI, SIGNALING           
KEYWDS   6 PROTEIN                                                              
EXPDTA    SOLUTION NMR                                                          
NUMMDL    20                                                                    
AUTHOR    N.TOCHIO,S.KOSHIBA,M.INOUE,T.KIGAWA,S.YOKOYAMA,RIKEN                  
AUTHOR   2 STRUCTURAL GENOMICS/PROTEOMICS INITIATIVE (RSGI)                     
REVDAT   2   24-FEB-09 1WFV    1       VERSN                                    
REVDAT   1   27-NOV-04 1WFV    0                                                
JRNL        AUTH   N.TOCHIO,S.KOSHIBA,M.INOUE,T.KIGAWA,S.YOKOYAMA               
JRNL        TITL   SOLUTION STRUCTURE OF THE FIFTH PDZ DOMAIN OF                
JRNL        TITL 2 HUMAN MEMBRANE ASSOCIATED GUANYLATE KINASE                   
JRNL        TITL 3 INVERTED-2 (KIAA0705 PROTEIN)                                
JRNL        REF    TO BE PUBLISHED                                              
JRNL        REFN                                                                
REMARK   1                                                                      
REMARK   2                                                                      
REMARK   2 RESOLUTION. NOT APPLICABLE.                                          
REMARK   3                                                                      
REMARK   3 REFINEMENT.                                                          
REMARK   3   PROGRAM     : CYANA 2.0.17                                         
REMARK   3   AUTHORS     : GUENTERT, P.                                         
REMARK   3                                                                      
REMARK   3  OTHER REFINEMENT REMARKS: NULL                                      
REMARK   4                                                                      
REMARK   4 1WFV COMPLIES WITH FORMAT V. 3.15, 01-DEC-08                         
REMARK 100                                                                      
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBJ ON 01-JUN-04.                  
REMARK 100 THE RCSB ID CODE IS RCSB023534.                                      
REMARK 210                                                                      
REMARK 210 EXPERIMENTAL DETAILS                                                 
REMARK 210  EXPERIMENT TYPE                : NMR                                
REMARK 210  TEMPERATURE           (KELVIN) : 298                                
REMARK 210  PH                             : 6.0                                
REMARK 210  IONIC STRENGTH                 : 120MM                              
REMARK 210  PRESSURE                       : AMBIENT                            
REMARK 210  SAMPLE CONTENTS                : 1.3MM PDZ DOMAIN U-15N, 13C;       
REMARK 210                                   20MM PHOSPHATE BUFFER NA;          
REMARK 210                                   100MM NACL; 1MM D-DTT; 0.02%       
REMARK 210                                   NAN3; 10% D2O                      
REMARK 210                                                                      
REMARK 210  NMR EXPERIMENTS CONDUCTED      : 3D_13C-SEPARATED_NOESY, 3D_        
REMARK 210                                   15N-SEPARATED_NOESY                
REMARK 210  SPECTROMETER FIELD STRENGTH    : 800 MHZ                            
REMARK 210  SPECTROMETER MODEL             : AVANCE                             
REMARK 210  SPECTROMETER MANUFACTURER      : BRUKER                             
REMARK 210                                                                      
REMARK 210  STRUCTURE DETERMINATION.                                            
REMARK 210   SOFTWARE USED                 : XWINNMR 2.6, NMRPIPE               
REMARK 210                                   20031121, NMRVIEW 5.0.4,           
REMARK 210                                   KUJIRA 0.8994, CYANA 2.0.17        
REMARK 210   METHOD USED                   : TORSION ANGLE DYNAMICS             
REMARK 210                                                                      
REMARK 210 CONFORMERS, NUMBER CALCULATED   : 100                                
REMARK 210 CONFORMERS, NUMBER SUBMITTED    : 20                                 
REMARK 210 CONFORMERS, SELECTION CRITERIA  : STRUCTURES WITH THE LEAST          
REMARK 210                                   RESTRAINT VIOLATIONS, TARGET       
REMARK 210                                   FUNCTION                           
REMARK 210                                                                      
REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : 1                   
REMARK 210                                                                      
REMARK 210 REMARK: NULL                                                         
REMARK 215                                                                      
REMARK 215 NMR STUDY                                                            
REMARK 215 THE COORDINATES IN THIS ENTRY WERE GENERATED FROM SOLUTION           
REMARK 215 NMR DATA.  PROTEIN DATA BANK CONVENTIONS REQUIRE THAT                
REMARK 215 CRYST1 AND SCALE RECORDS BE INCLUDED, BUT THE VALUES ON              
REMARK 215 THESE RECORDS ARE MEANINGLESS.                                       
REMARK 500                                                                      
REMARK 500 GEOMETRY AND STEREOCHEMISTRY                                         
REMARK 500 SUBTOPIC: TORSION ANGLES                                             
REMARK 500                                                                      
REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS:            
REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER;               
REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE).                             
REMARK 500                                                                      
REMARK 500 STANDARD TABLE:                                                      
REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2)                    
REMARK 500                                                                      
REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI-           
REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400            
REMARK 500                                                                      
REMARK 500  M RES CSSEQI        PSI       PHI                                   
REMARK 500  1 PHE A  10     -177.80    -61.53                                   
REMARK 500  1 SER A  68      120.63    -34.49                                   
REMARK 500  1 ASP A  71       27.85     48.37                                   
REMARK 500  1 HIS A  74      -34.22    -37.20                                   
REMARK 500  2 ASP A   9      159.58    -43.50                                   
REMARK 500  2 PHE A  24       37.52    -82.25                                   
REMARK 500  2 ARG A  54      -29.20    -36.84                                   
REMARK 500  2 THR A  69       -9.67    -59.08                                   
REMARK 500  2 SER A  98      148.72   -174.65                                   
REMARK 500  3 SER A   3       41.96    -95.77                                   
REMARK 500  3 PHE A  10       43.67    -78.88                                   
REMARK 500  3 ASP A  11       54.67     73.79                                   
REMARK 500  3 TYR A  12       89.64    -47.93                                   
REMARK 500  3 ARG A  54      -32.01    -37.61                                   
REMARK 500  3 THR A  69       49.13    -96.20                                   
REMARK 500  3 HIS A  74      -36.13    -34.44                                   
REMARK 500  4 PHE A  10     -174.90    -63.02                                   
REMARK 500  4 ARG A  54      -31.01    -37.46                                   
REMARK 500  4 SER A  68      104.21    -57.63                                   
REMARK 500  4 PRO A 100        0.51    -69.75                                   
REMARK 500  5 SER A   6       76.54   -110.92                                   
REMARK 500  5 ASP A   9     -175.46    -51.42                                   
REMARK 500  5 PHE A  10     -175.89    -52.18                                   
REMARK 500  5 TYR A  12       75.95   -107.47                                   
REMARK 500  5 PHE A  24       39.40    -82.31                                   
REMARK 500  5 ARG A  54      -32.66    -34.52                                   
REMARK 500  5 THR A  69       51.85    -94.55                                   
REMARK 500  6 ASP A   9     -175.40    -60.03                                   
REMARK 500  6 ASP A  11      126.89    -38.53                                   
REMARK 500  6 PHE A  24       40.67    -81.45                                   
REMARK 500  6 ARG A  54      -29.54    -36.37                                   
REMARK 500  6 SER A  98       42.36    -89.43                                   
REMARK 500  7 SER A   2       41.40   -100.59                                   
REMARK 500  7 ASP A  11      103.41    -42.36                                   
REMARK 500  7 ARG A  54      -30.34    -36.48                                   
REMARK 500  7 SER A  68      109.29    -38.09                                   
REMARK 500  7 HIS A  74      -36.95    -38.51                                   
REMARK 500  7 SER A 101       42.95    -81.89                                   
REMARK 500  8 SER A   3       96.17    -54.35                                   
REMARK 500  8 GLN A   8       34.90    -86.03                                   
REMARK 500  8 ASP A  11      114.52   -172.75                                   
REMARK 500  8 TYR A  12       75.48   -116.66                                   
REMARK 500  8 ARG A  54      -29.75    -36.98                                   
REMARK 500  8 HIS A  74      -37.40    -34.05                                   
REMARK 500  8 SER A  98      128.98   -170.46                                   
REMARK 500  8 PRO A 100       91.47    -69.75                                   
REMARK 500  9 ASP A  11      104.95   -175.07                                   
REMARK 500  9 PHE A  24       40.28    -81.78                                   
REMARK 500  9 ARG A  54      -33.30    -33.76                                   
REMARK 500  9 ASP A  59      173.84    -56.15                                   
REMARK 500  9 HIS A  74      -37.04    -36.72                                   
REMARK 500  9 PRO A 100       82.57    -69.74                                   
REMARK 500 10 ASP A   9     -175.50    -67.31                                   
REMARK 500 10 ASP A  11      100.40    -59.78                                   
REMARK 500 10 PHE A  24       41.90    -78.89                                   
REMARK 500 10 ARG A  54      -30.11    -35.99                                   
REMARK 500 10 THR A  69       50.00   -101.58                                   
REMARK 500 10 HIS A  74      -37.61    -39.82                                   
REMARK 500 11 PHE A  10     -178.97    -55.12                                   
REMARK 500 11 THR A  69       55.62   -107.97                                   
REMARK 500 11 HIS A  74      -33.94    -34.25                                   
REMARK 500 11 SER A  98       37.29    -89.55                                   
REMARK 500 11 PRO A 100      -91.46    -69.75                                   
REMARK 500 12 ARG A  54      -32.09    -34.32                                   
REMARK 500 12 ASP A  59     -179.17    -63.12                                   
REMARK 500 12 ASP A  71       51.91   -105.99                                   
REMARK 500 12 SER A  98       39.96    -94.44                                   
REMARK 500 12 PRO A 100     -177.99    -69.82                                   
REMARK 500 12 SER A 102      102.35    -53.95                                   
REMARK 500 13 SER A   5       42.85    -99.44                                   
REMARK 500 13 SER A   6      147.41    -35.32                                   
REMARK 500 13 ASP A  11      115.03   -174.97                                   
REMARK 500 13 TYR A  12       83.16    -69.65                                   
REMARK 500 13 PHE A  24       28.25     38.27                                   
REMARK 500 13 ARG A  54      -31.44    -35.20                                   
REMARK 500 13 THR A  69       49.32    -93.16                                   
REMARK 500 13 ASP A  71       51.34   -119.41                                   
REMARK 500 13 HIS A  74      -33.52    -34.65                                   
REMARK 500 13 SER A 101       40.38    -83.89                                   
REMARK 500 14 SER A   2       42.08    -86.54                                   
REMARK 500 14 SER A   3      153.68    -44.81                                   
REMARK 500 14 SER A   5       36.57     37.49                                   
REMARK 500 14 ASP A   9      -75.39    -68.42                                   
REMARK 500 14 PHE A  10      139.41   -175.47                                   
REMARK 500 14 PHE A  24       37.29    -82.92                                   
REMARK 500 14 ARG A  54      -34.56    -37.86                                   
REMARK 500 14 ASN A  65       27.00     44.59                                   
REMARK 500 14 THR A  69       73.54    -66.19                                   
REMARK 500 14 HIS A  74      -27.50    -38.66                                   
REMARK 500 14 PRO A 100        0.09    -69.73                                   
REMARK 500 15 ASP A  11      119.63   -168.23                                   
REMARK 500 15 LYS A  22       30.36    -94.99                                   
REMARK 500 15 ARG A  54      -28.04    -38.93                                   
REMARK 500 15 ASN A  65       25.78     41.07                                   
REMARK 500 15 HIS A  74      -31.96    -36.17                                   
REMARK 500 16 SER A   5      111.79    -37.71                                   
REMARK 500 16 ASP A  11      106.22   -164.09                                   
REMARK 500 16 PHE A  24       25.86     38.92                                   
REMARK 500 16 ARG A  54      -36.00    -32.17                                   
REMARK 500 16 THR A  69       47.17   -106.14                                   
REMARK 500 16 HIS A  74      -36.16    -33.89                                   
REMARK 500 16 THR A  96       24.95     39.42                                   
REMARK 500 16 SER A  98      153.36    -38.25                                   
REMARK 500 16 PRO A 100        4.75    -69.78                                   
REMARK 500 16 SER A 101       33.52    -84.87                                   
REMARK 500 17 SER A   5      127.87    -38.55                                   
REMARK 500 17 SER A   6      142.66    -37.89                                   
REMARK 500 17 ASP A  11      108.32    -43.44                                   
REMARK 500 17 PHE A  24       34.29    -84.96                                   
REMARK 500 17 ASN A  65       48.55     33.64                                   
REMARK 500 17 SER A  68      109.00    -42.62                                   
REMARK 500 17 HIS A  74      -35.89    -35.37                                   
REMARK 500 18 ASP A   9      172.82    -47.68                                   
REMARK 500 18 ASP A  11      105.92   -175.11                                   
REMARK 500 18 ARG A  54      -32.93    -34.30                                   
REMARK 500 18 THR A  69       43.32     33.36                                   
REMARK 500 18 HIS A  74      -39.26    -39.11                                   
REMARK 500 18 THR A  96       24.99     39.41                                   
REMARK 500 18 PRO A 100        1.72    -69.77                                   
REMARK 500 19 SER A   3      112.83   -169.43                                   
REMARK 500 19 PHE A  24       39.62    -81.92                                   
REMARK 500 19 ARG A  54      -31.10    -35.75                                   
REMARK 500 19 THR A  69       47.07    -85.65                                   
REMARK 500 19 SER A  98      104.76    -40.20                                   
REMARK 500 20 ASP A  11      118.65   -167.37                                   
REMARK 500 20 ARG A  56     -175.77   -175.58                                   
REMARK 500 20 HIS A  74      -38.57    -34.28                                   
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
REMARK 900                                                                      
REMARK 900 RELATED ENTRIES                                                      
REMARK 900 RELATED ID: HSK002000688.1   RELATED DB: TARGETDB                    
DBREF  1WFV A    8    97  UNP    Q86UL8   AIP1_HUMAN    1169   1258             
SEQADV 1WFV GLY A    1  UNP  Q86UL8              CLONING ARTIFACT               
SEQADV 1WFV SER A    2  UNP  Q86UL8              CLONING ARTIFACT               
SEQADV 1WFV SER A    3  UNP  Q86UL8              CLONING ARTIFACT               
SEQADV 1WFV GLY A    4  UNP  Q86UL8              CLONING ARTIFACT               
SEQADV 1WFV SER A    5  UNP  Q86UL8              CLONING ARTIFACT               
SEQADV 1WFV SER A    6  UNP  Q86UL8              CLONING ARTIFACT               
SEQADV 1WFV GLY A    7  UNP  Q86UL8              CLONING ARTIFACT               
SEQADV 1WFV SER A   98  UNP  Q86UL8              CLONING ARTIFACT               
SEQADV 1WFV GLY A   99  UNP  Q86UL8              CLONING ARTIFACT               
SEQADV 1WFV PRO A  100  UNP  Q86UL8              CLONING ARTIFACT               
SEQADV 1WFV SER A  101  UNP  Q86UL8              CLONING ARTIFACT               
SEQADV 1WFV SER A  102  UNP  Q86UL8              CLONING ARTIFACT               
SEQADV 1WFV GLY A  103  UNP  Q86UL8              CLONING ARTIFACT               
SEQRES   1 A  103  GLY SER SER GLY SER SER GLY GLN ASP PHE ASP TYR PHE          
SEQRES   2 A  103  THR VAL ASP MET GLU LYS GLY ALA LYS GLY PHE GLY PHE          
SEQRES   3 A  103  SER ILE ARG GLY GLY ARG GLU TYR LYS MET ASP LEU TYR          
SEQRES   4 A  103  VAL LEU ARG LEU ALA GLU ASP GLY PRO ALA ILE ARG ASN          
SEQRES   5 A  103  GLY ARG MET ARG VAL GLY ASP GLN ILE ILE GLU ILE ASN          
SEQRES   6 A  103  GLY GLU SER THR ARG ASP MET THR HIS ALA ARG ALA ILE          
SEQRES   7 A  103  GLU LEU ILE LYS SER GLY GLY ARG ARG VAL ARG LEU LEU          
SEQRES   8 A  103  LEU LYS ARG GLY THR GLY SER GLY PRO SER SER GLY              
HELIX    1   1 GLY A   47  GLY A   53  1                                   7    
HELIX    2   2 THR A   73  GLY A   85  1                                  13    
SHEET    1   A 5 PHE A  13  THR A  14  0                                        
SHEET    2   A 5 LEU A  90  LYS A  93 -1  O  LEU A  92   N  PHE A  13           
SHEET    3   A 5 GLN A  60  ILE A  64 -1  N  ILE A  62   O  LEU A  91           
SHEET    4   A 5 MET A  36  TYR A  39 -1  N  LEU A  38   O  ILE A  61           
SHEET    5   A 5 ARG A  29  GLY A  31 -1  N  ARG A  29   O  TYR A  39           
SHEET    1   B 4 PHE A  13  THR A  14  0                                        
SHEET    2   B 4 LEU A  90  LYS A  93 -1  O  LEU A  92   N  PHE A  13           
SHEET    3   B 4 GLN A  60  ILE A  64 -1  N  ILE A  62   O  LEU A  91           
SHEET    4   B 4 GLU A  67  SER A  68 -1  O  GLU A  67   N  ILE A  64           
SHEET    1   C 2 MET A  17  GLU A  18  0                                        
SHEET    2   C 2 ARG A  87  VAL A  88 -1  O  VAL A  88   N  MET A  17           
CRYST1    1.000    1.000    1.000  90.00  90.00  90.00 P 1           1          
ORIGX1      1.000000  0.000000  0.000000        0.00000                         
ORIGX2      0.000000  1.000000  0.000000        0.00000                         
ORIGX3      0.000000  0.000000  1.000000        0.00000                         
SCALE1      1.000000  0.000000  0.000000        0.00000                         
SCALE2      0.000000  1.000000  0.000000        0.00000                         
SCALE3      0.000000  0.000000  1.000000        0.00000                         
MODEL        1                                                                  
(ATOM LINES ARE NOT SHOWN.)
END                                                                             
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