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Database: PDB
Entry: 1JBH
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Original site: 1JBH 
HEADER    LIPID BINDING PROTEIN                   04-JUN-01   1JBH              
TITLE     SOLUTION STRUCTURE OF CELLULAR RETINOL BINDING PROTEIN TYPE-          
TITLE    2 I IN THE LIGAND-FREE STATE                                           
COMPND    MOL_ID: 1;                                                            
COMPND   2 MOLECULE: CELLULAR RETINOL-BINDING PROTEIN TYPE I;                   
COMPND   3 CHAIN: A;                                                            
COMPND   4 SYNONYM: CRBP-I;                                                     
COMPND   5 ENGINEERED: YES                                                      
SOURCE    MOL_ID: 1;                                                            
SOURCE   2 ORGANISM_SCIENTIFIC: RATTUS NORVEGICUS;                              
SOURCE   3 ORGANISM_COMMON: NORWAY RAT;                                         
SOURCE   4 ORGANISM_TAXID: 10116;                                               
SOURCE   5 GENE: RBP-1;                                                         
SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21;                            
SOURCE   7 EXPRESSION_SYSTEM_TAXID: 511693;                                     
SOURCE   8 EXPRESSION_SYSTEM_STRAIN: BL21;                                      
SOURCE   9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
SOURCE  10 EXPRESSION_SYSTEM_PLASMID: PET11B                                    
KEYWDS    BETA BARREL, RETINOID CARRIER, APO FORM, NMR SPECTROSCOPY,            
KEYWDS   2 15N ISOTOPE ENRICHMENT, LIPID BINDING PROTEIN                        
EXPDTA    SOLUTION NMR                                                          
NUMMDL    20                                                                    
AUTHOR    L.FRANZONI,C.LUECKE,C.PEREZ,D.CAVAZZINI,M.RADEMACHER,                 
AUTHOR   2 C.LUDWIG,A.SPISNI,G.L.ROSSI,H.RUETERJANS                             
REVDAT   3   24-FEB-09 1JBH    1       VERSN                                    
REVDAT   2   01-APR-03 1JBH    1       JRNL                                     
REVDAT   1   19-JUN-02 1JBH    0                                                
JRNL        AUTH   L.FRANZONI,C.LUCKE,C.PEREZ,D.CAVAZZINI,                      
JRNL        AUTH 2 M.RADEMACHER,C.LUDWIG,A.SPISNI,G.L.ROSSI,                    
JRNL        AUTH 3 H.RUTERJANS                                                  
JRNL        TITL   STRUCTURE AND BACKBONE DYNAMICS OF APO- AND                  
JRNL        TITL 2 HOLO-CELLULAR RETINOL-BINDING PROTEIN IN SOLUTION.           
JRNL        REF    J.BIOL.CHEM.                  V. 277 21983 2002              
JRNL        REFN                   ISSN 0021-9258                               
JRNL        PMID   11934897                                                     
JRNL        DOI    10.1074/JBC.M201994200                                       
REMARK   1                                                                      
REMARK   1 REFERENCE 1                                                          
REMARK   1  AUTH   S.W.COWAN,M.E.NEWCOMER,T.A.JONES                             
REMARK   1  TITL   CRYSTALLOGRAPHIC STUDIES ON A FAMILY OF CELLULAR             
REMARK   1  TITL 2 LIPOPHILIC TRANSPORT PROTEINS                                
REMARK   1  REF    J.MOL.BIOL.                   V. 230  1225 1993              
REMARK   1  REFN                   ISSN 0022-2836                               
REMARK   1  DOI    10.1006/JMBI.1993.1238                                       
REMARK   2                                                                      
REMARK   2 RESOLUTION. NOT APPLICABLE.                                          
REMARK   3                                                                      
REMARK   3 REFINEMENT.                                                          
REMARK   3   PROGRAM     : DISCOVER 97                                          
REMARK   3   AUTHORS     : MSI                                                  
REMARK   3                                                                      
REMARK   3  OTHER REFINEMENT REMARKS: THE STRUCTURES ARE BASED ON A TOTAL       
REMARK   3  OF 2409 NOE-DERIVED DISTANCE RESTRAINTS                             
REMARK   4                                                                      
REMARK   4 1JBH COMPLIES WITH FORMAT V. 3.15, 01-DEC-08                         
REMARK 100                                                                      
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 13-JUN-01.                  
REMARK 100 THE RCSB ID CODE IS RCSB013586.                                      
REMARK 210                                                                      
REMARK 210 EXPERIMENTAL DETAILS                                                 
REMARK 210  EXPERIMENT TYPE                : NMR                                
REMARK 210  TEMPERATURE           (KELVIN) : 298.00                             
REMARK 210  PH                             : 6.00                               
REMARK 210  IONIC STRENGTH                 : 20MM POTASSIUM PHOSPHATE           
REMARK 210  PRESSURE                       : AMBIENT                            
REMARK 210  SAMPLE CONTENTS                : 1.6MM CRBP-I PHOSPHATE             
REMARK 210                                   BUFFER; 0.05% SODIUM AZIDE         
REMARK 210                                                                      
REMARK 210  NMR EXPERIMENTS CONDUCTED      : 2D_TOCSY, 2D_NOESY, 2D_15N-        
REMARK 210                                   HSQC, 2D_15N-HTQC, 3D_15N-         
REMARK 210                                   TOCSY-HSQC, 3D_15N-NOESY-HSQC      
REMARK 210  SPECTROMETER FIELD STRENGTH    : 600 MHZ                            
REMARK 210  SPECTROMETER MODEL             : DMX                                
REMARK 210  SPECTROMETER MANUFACTURER      : BRUKER                             
REMARK 210                                                                      
REMARK 210  STRUCTURE DETERMINATION.                                            
REMARK 210   SOFTWARE USED                 : XWINNMR 1.3, AURELIA 2.5.9,        
REMARK 210                                   FELIX 97, NMR2ST 2.05, DYANA       
REMARK 210                                   1.5                                
REMARK 210   METHOD USED                   : TORSION ANGLE DYNAMICS             
REMARK 210                                   COMBINED WITH SIMULATED            
REMARK 210                                   ANNEALING FOLLOWED BY ENERGY       
REMARK 210                                   MINIMIZATION                       
REMARK 210                                                                      
REMARK 210 CONFORMERS, NUMBER CALCULATED   : 100                                
REMARK 210 CONFORMERS, NUMBER SUBMITTED    : 20                                 
REMARK 210 CONFORMERS, SELECTION CRITERIA  : TARGET FUNCTION                    
REMARK 210                                                                      
REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : NULL                
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: COVALENT BOND LENGTHS                                      
REMARK 500                                                                      
REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES              
REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE               
REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN               
REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE).                 
REMARK 500                                                                      
REMARK 500 STANDARD TABLE:                                                      
REMARK 500 FORMAT: (10X,I3,1X,2(A3,1X,A1,I4,A1,1X,A4,3X),1X,F6.3)               
REMARK 500                                                                      
REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999                        
REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996                     
REMARK 500                                                                      
REMARK 500  M RES CSSEQI ATM1   RES CSSEQI ATM2   DEVIATION                     
REMARK 500  1 GLU A  14   CD    GLU A  14   OE2     0.108                       
REMARK 500  1 GLU A  17   CD    GLU A  17   OE2     0.113                       
REMARK 500  1 GLU A  18   CD    GLU A  18   OE2     0.109                       
REMARK 500  1 GLU A  41   CD    GLU A  41   OE2     0.113                       
REMARK 500  1 HIS A  48   CG    HIS A  48   CD2     0.059                       
REMARK 500  1 GLU A  69   CD    GLU A  69   OE2     0.117                       
REMARK 500  1 GLU A  71   CD    GLU A  71   OE2     0.114                       
REMARK 500  1 GLU A  72   CD    GLU A  72   OE2     0.108                       
REMARK 500  1 GLU A 100   CD    GLU A 100   OE2     0.115                       
REMARK 500  1 GLU A 102   CD    GLU A 102   OE2     0.110                       
REMARK 500  1 GLU A 111   CD    GLU A 111   OE2     0.111                       
REMARK 500  1 GLU A 114   CD    GLU A 114   OE2     0.118                       
REMARK 500  1 GLU A 118   CD    GLU A 118   OE2     0.114                       
REMARK 500  1 GLU A 122   CD    GLU A 122   OE2     0.113                       
REMARK 500  2 GLU A  14   CD    GLU A  14   OE2     0.110                       
REMARK 500  2 GLU A  17   CD    GLU A  17   OE2     0.113                       
REMARK 500  2 GLU A  18   CD    GLU A  18   OE2     0.111                       
REMARK 500  2 GLU A  41   CD    GLU A  41   OE2     0.114                       
REMARK 500  2 HIS A  48   CG    HIS A  48   CD2     0.059                       
REMARK 500  2 GLU A  69   CD    GLU A  69   OE2     0.112                       
REMARK 500  2 GLU A  71   CD    GLU A  71   OE2     0.116                       
REMARK 500  2 GLU A  72   CD    GLU A  72   OE2     0.111                       
REMARK 500  2 GLU A 100   CD    GLU A 100   OE2     0.110                       
REMARK 500  2 GLU A 102   CD    GLU A 102   OE2     0.110                       
REMARK 500  2 GLU A 111   CD    GLU A 111   OE2     0.109                       
REMARK 500  2 GLU A 114   CD    GLU A 114   OE2     0.108                       
REMARK 500  2 GLU A 118   CD    GLU A 118   OE2     0.114                       
REMARK 500  2 GLU A 122   CD    GLU A 122   OE2     0.111                       
REMARK 500  3 GLU A  14   CD    GLU A  14   OE2     0.110                       
REMARK 500  3 GLU A  17   CD    GLU A  17   OE2     0.115                       
REMARK 500  3 GLU A  18   CD    GLU A  18   OE2     0.116                       
REMARK 500  3 GLU A  41   CD    GLU A  41   OE2     0.109                       
REMARK 500  3 HIS A  48   CG    HIS A  48   CD2     0.061                       
REMARK 500  3 GLU A  69   CD    GLU A  69   OE2     0.109                       
REMARK 500  3 GLU A  71   CD    GLU A  71   OE2     0.114                       
REMARK 500  3 GLU A  72   CD    GLU A  72   OE2     0.109                       
REMARK 500  3 GLU A 100   CD    GLU A 100   OE2     0.113                       
REMARK 500  3 GLU A 102   CD    GLU A 102   OE2     0.110                       
REMARK 500  3 GLU A 111   CD    GLU A 111   OE2     0.118                       
REMARK 500  3 GLU A 114   CD    GLU A 114   OE2     0.112                       
REMARK 500  3 GLU A 118   CD    GLU A 118   OE2     0.113                       
REMARK 500  3 GLU A 122   CD    GLU A 122   OE2     0.109                       
REMARK 500  4 GLU A  14   CD    GLU A  14   OE2     0.113                       
REMARK 500  4 GLU A  17   CD    GLU A  17   OE2     0.110                       
REMARK 500  4 GLU A  18   CD    GLU A  18   OE2     0.111                       
REMARK 500  4 GLU A  41   CD    GLU A  41   OE2     0.110                       
REMARK 500  4 HIS A  48   CG    HIS A  48   CD2     0.061                       
REMARK 500  4 GLU A  69   CD    GLU A  69   OE2     0.110                       
REMARK 500  4 GLU A  71   CD    GLU A  71   OE2     0.114                       
REMARK 500  4 GLU A  72   CD    GLU A  72   OE2     0.113                       
REMARK 500                                                                      
REMARK 500 THIS ENTRY HAS     282 BOND DEVIATIONS.                              
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
REMARK 500                                                                      
REMARK 500 GEOMETRY AND STEREOCHEMISTRY                                         
REMARK 500 SUBTOPIC: COVALENT BOND ANGLES                                       
REMARK 500                                                                      
REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES              
REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE               
REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN               
REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE).                 
REMARK 500                                                                      
REMARK 500 STANDARD TABLE:                                                      
REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1)              
REMARK 500                                                                      
REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999                        
REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996                     
REMARK 500                                                                      
REMARK 500  M RES CSSEQI ATM1   ATM2   ATM3                                     
REMARK 500  1 ASP A   3   CB  -  CG  -  OD1 ANGL. DEV. =   5.7 DEGREES          
REMARK 500  1 ASP A   3   CB  -  CG  -  OD2 ANGL. DEV. =  -6.1 DEGREES          
REMARK 500  1 ARG A  21   NE  -  CZ  -  NH1 ANGL. DEV. =   4.0 DEGREES          
REMARK 500  1 ASP A  24   CB  -  CG  -  OD2 ANGL. DEV. =  -5.9 DEGREES          
REMARK 500  1 ARG A  30   NE  -  CZ  -  NH1 ANGL. DEV. =   4.0 DEGREES          
REMARK 500  1 ASP A  39   CB  -  CG  -  OD1 ANGL. DEV. =   5.5 DEGREES          
REMARK 500  1 ASP A  39   CB  -  CG  -  OD2 ANGL. DEV. =  -5.8 DEGREES          
REMARK 500  1 ASP A  45   CB  -  CG  -  OD2 ANGL. DEV. =  -5.7 DEGREES          
REMARK 500  1 ASP A  47   CB  -  CG  -  OD1 ANGL. DEV. =   6.3 DEGREES          
REMARK 500  1 ASP A  47   CB  -  CG  -  OD2 ANGL. DEV. =  -6.3 DEGREES          
REMARK 500  1 HIS A  48   ND1 -  CE1 -  NE2 ANGL. DEV. =   8.7 DEGREES          
REMARK 500  1 ARG A  52   NE  -  CZ  -  NH1 ANGL. DEV. =   4.4 DEGREES          
REMARK 500  1 ARG A  58   NE  -  CZ  -  NH1 ANGL. DEV. =   4.1 DEGREES          
REMARK 500  1 ASP A  63   CB  -  CG  -  OD2 ANGL. DEV. =  -5.8 DEGREES          
REMARK 500  1 ASP A  73   CB  -  CG  -  OD1 ANGL. DEV. =   6.8 DEGREES          
REMARK 500  1 ASP A  73   CB  -  CG  -  OD2 ANGL. DEV. =  -7.0 DEGREES          
REMARK 500  1 ASP A  78   CB  -  CG  -  OD1 ANGL. DEV. =   6.4 DEGREES          
REMARK 500  1 ASP A  78   CB  -  CG  -  OD2 ANGL. DEV. =  -6.7 DEGREES          
REMARK 500  1 ASP A  79   CB  -  CG  -  OD1 ANGL. DEV. =   5.8 DEGREES          
REMARK 500  1 ASP A  79   CB  -  CG  -  OD2 ANGL. DEV. =  -5.9 DEGREES          
REMARK 500  1 ARG A  80   NE  -  CZ  -  NH1 ANGL. DEV. =   4.2 DEGREES          
REMARK 500  1 ARG A  80   NE  -  CZ  -  NH2 ANGL. DEV. =  -3.1 DEGREES          
REMARK 500  1 ASP A  89   CB  -  CG  -  OD2 ANGL. DEV. =  -6.0 DEGREES          
REMARK 500  1 ARG A 104   NE  -  CZ  -  NH1 ANGL. DEV. =   3.9 DEGREES          
REMARK 500  1 ASP A 113   CB  -  CG  -  OD1 ANGL. DEV. =   6.4 DEGREES          
REMARK 500  1 ASP A 113   CB  -  CG  -  OD2 ANGL. DEV. =  -6.8 DEGREES          
REMARK 500  1 HIS A 116   ND1 -  CE1 -  NE2 ANGL. DEV. =   8.5 DEGREES          
REMARK 500  1 ARG A 120   NE  -  CZ  -  NH1 ANGL. DEV. =   4.1 DEGREES          
REMARK 500  1 HIS A 134   ND1 -  CE1 -  NE2 ANGL. DEV. =   8.5 DEGREES          
REMARK 500  2 ASP A   3   CB  -  CG  -  OD2 ANGL. DEV. =  -5.7 DEGREES          
REMARK 500  2 ARG A  21   NE  -  CZ  -  NH1 ANGL. DEV. =   4.2 DEGREES          
REMARK 500  2 ASP A  24   CB  -  CG  -  OD2 ANGL. DEV. =  -5.7 DEGREES          
REMARK 500  2 ARG A  30   NE  -  CZ  -  NH1 ANGL. DEV. =   4.0 DEGREES          
REMARK 500  2 ASP A  39   CB  -  CG  -  OD1 ANGL. DEV. =   5.4 DEGREES          
REMARK 500  2 ASP A  39   CB  -  CG  -  OD2 ANGL. DEV. =  -5.9 DEGREES          
REMARK 500  2 ASP A  45   CB  -  CG  -  OD2 ANGL. DEV. =  -6.3 DEGREES          
REMARK 500  2 ASP A  47   CB  -  CG  -  OD1 ANGL. DEV. =   5.4 DEGREES          
REMARK 500  2 ASP A  47   CB  -  CG  -  OD2 ANGL. DEV. =  -5.7 DEGREES          
REMARK 500  2 HIS A  48   ND1 -  CE1 -  NE2 ANGL. DEV. =   8.6 DEGREES          
REMARK 500  2 ARG A  52   NE  -  CZ  -  NH1 ANGL. DEV. =   4.2 DEGREES          
REMARK 500  2 ARG A  58   NE  -  CZ  -  NH1 ANGL. DEV. =   4.0 DEGREES          
REMARK 500  2 ASP A  73   CB  -  CG  -  OD1 ANGL. DEV. =   5.6 DEGREES          
REMARK 500  2 ASP A  73   CB  -  CG  -  OD2 ANGL. DEV. =  -6.4 DEGREES          
REMARK 500  2 ASP A  79   CB  -  CG  -  OD2 ANGL. DEV. =  -6.2 DEGREES          
REMARK 500  2 ARG A  80   NE  -  CZ  -  NH1 ANGL. DEV. =   4.2 DEGREES          
REMARK 500  2 ASP A  89   CB  -  CG  -  OD1 ANGL. DEV. =   6.2 DEGREES          
REMARK 500  2 ASP A  89   CB  -  CG  -  OD2 ANGL. DEV. =  -6.3 DEGREES          
REMARK 500  2 ASP A  91   CB  -  CG  -  OD2 ANGL. DEV. =  -5.7 DEGREES          
REMARK 500  2 ARG A 104   NE  -  CZ  -  NH1 ANGL. DEV. =   4.1 DEGREES          
REMARK 500  2 ASP A 113   CB  -  CG  -  OD1 ANGL. DEV. =   5.7 DEGREES          
REMARK 500                                                                      
REMARK 500 THIS ENTRY HAS     520 ANGLE DEVIATIONS.                             
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
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 ASN A   5      109.51    -51.84                                   
REMARK 500  1 GLU A  14      -70.23    -77.18                                   
REMARK 500  1 LYS A  37       78.99   -112.54                                   
REMARK 500  1 ILE A  61       97.64     74.50                                   
REMARK 500  2 ALA A  33      -51.95   -172.79                                   
REMARK 500  2 THR A  56       49.22    -77.64                                   
REMARK 500  2 PHE A  57      -66.43   -172.53                                   
REMARK 500  2 ASP A  73     -123.60     69.49                                   
REMARK 500  2 ILE A  77      -75.00    -83.55                                   
REMARK 500  2 ASP A  79       73.09     64.58                                   
REMARK 500  3 LEU A  11      -60.16    -90.97                                   
REMARK 500  3 LYS A  37       65.54     64.76                                   
REMARK 500  3 ASP A  45       69.31   -113.94                                   
REMARK 500  3 PHE A  57      -67.04   -173.20                                   
REMARK 500  3 ARG A  80       52.01   -108.11                                   
REMARK 500  3 LYS A  81       81.60     61.88                                   
REMARK 500  3 GLN A  97       75.02   -101.95                                   
REMARK 500  3 GLU A 122       -0.32     64.80                                   
REMARK 500  4 ALA A  33      -53.59   -176.03                                   
REMARK 500  4 PHE A  57      -67.93   -168.99                                   
REMARK 500  4 ILE A  77      -71.57     70.04                                   
REMARK 500  4 MET A  83       96.16    -68.63                                   
REMARK 500  4 ASP A  89       65.79   -103.77                                   
REMARK 500  4 GLU A 100      -58.76   -125.18                                   
REMARK 500  4 GLU A 122      -76.19     69.58                                   
REMARK 500  5 ALA A  33      -47.29   -179.45                                   
REMARK 500  5 ASP A  47      -33.80     65.26                                   
REMARK 500  5 PHE A  57      -68.64   -167.26                                   
REMARK 500  5 ASP A  79       66.11     63.34                                   
REMARK 500  5 ASP A  89       65.70   -108.58                                   
REMARK 500  5 GLN A  97       75.98   -103.93                                   
REMARK 500  6 ASP A  45       70.58   -100.33                                   
REMARK 500  6 PHE A  57      -68.61   -174.06                                   
REMARK 500  6 LEU A  74       74.98     57.16                                   
REMARK 500  6 ASP A  78       68.74    -67.04                                   
REMARK 500  7 ASP A  47      -10.79     59.97                                   
REMARK 500  7 SER A  55       -3.13   -153.47                                   
REMARK 500  7 THR A  56      -62.97     75.40                                   
REMARK 500  7 ASP A  73     -159.75   -119.27                                   
REMARK 500  7 THR A  75       -1.70     55.58                                   
REMARK 500  7 ASP A  79     -101.88    -99.07                                   
REMARK 500  7 ARG A  80     -124.43   -140.83                                   
REMARK 500  8 ASP A   3       99.41    -67.92                                   
REMARK 500  8 ASP A  45       64.59   -116.20                                   
REMARK 500  8 ARG A  58     -117.15   -151.08                                   
REMARK 500  8 ILE A  61       92.70     62.02                                   
REMARK 500  8 ILE A  77      -87.58     68.79                                   
REMARK 500  9 PRO A   1     -137.97    -80.72                                   
REMARK 500  9 ASP A  47      -34.56     76.71                                   
REMARK 500  9 PHE A  57      -67.82   -168.81                                   
REMARK 500  9 TYR A  60      -75.02    -95.96                                   
REMARK 500  9 ILE A  61      108.75     74.62                                   
REMARK 500  9 THR A  75      100.67   -162.59                                   
REMARK 500  9 ILE A  77      -87.01   -108.83                                   
REMARK 500  9 ASP A  79      -70.79    -78.45                                   
REMARK 500  9 ASP A  89       71.00   -107.57                                   
REMARK 500 10 PRO A   1     -122.12    -78.15                                   
REMARK 500 10 ASP A  45       72.32   -112.56                                   
REMARK 500 10 PHE A  57      -70.79   -169.95                                   
REMARK 500 10 TYR A  60      -77.40    -91.35                                   
REMARK 500 10 ILE A  61      108.35     79.46                                   
REMARK 500 10 LEU A  74      -76.54     74.79                                   
REMARK 500 10 ASP A  78      -91.90   -100.21                                   
REMARK 500 10 ASP A  79       71.29   -154.20                                   
REMARK 500 10 ASP A  89       67.18   -103.66                                   
REMARK 500 10 GLU A 100      -68.47     69.61                                   
REMARK 500 11 ASP A  45       70.46   -102.27                                   
REMARK 500 11 ASP A  47      -36.99     82.07                                   
REMARK 500 11 THR A  75      122.00     74.45                                   
REMARK 500 11 ILE A  77      -79.69    -82.71                                   
REMARK 500 11 ASP A  89       73.30   -109.35                                   
REMARK 500 12 PRO A   1      -99.07    -72.28                                   
REMARK 500 12 ALA A  33      -56.98   -177.07                                   
REMARK 500 12 ASP A  47      -43.53     77.81                                   
REMARK 500 12 THR A  56        4.16    -68.35                                   
REMARK 500 12 TYR A  60      -66.91    -95.97                                   
REMARK 500 12 ILE A  61       91.35     69.76                                   
REMARK 500 12 ILE A  77      -83.84     58.32                                   
REMARK 500 12 ASP A  89       67.03   -102.54                                   
REMARK 500 13 VAL A   2      -98.31    -97.56                                   
REMARK 500 13 ASP A   3       79.15   -152.10                                   
REMARK 500 13 ALA A  33      -51.71   -176.03                                   
REMARK 500 13 PHE A  57      -64.53   -172.42                                   
REMARK 500 13 TYR A  60      -74.92    -91.41                                   
REMARK 500 13 ILE A  61       93.45     75.87                                   
REMARK 500 13 THR A  75      118.59     84.85                                   
REMARK 500 13 ILE A  77      -67.39   -129.05                                   
REMARK 500 13 ASP A  79      153.93     70.17                                   
REMARK 500 13 ARG A  80       64.86     73.17                                   
REMARK 500 14 PRO A   1      -85.39    -62.89                                   
REMARK 500 14 VAL A   2      130.34   -178.30                                   
REMARK 500 14 ASP A  24       61.64     62.43                                   
REMARK 500 14 ALA A  33      -47.21   -174.98                                   
REMARK 500 14 ASP A  45       73.93   -101.81                                   
REMARK 500 14 ASP A  47      -30.37     70.20                                   
REMARK 500 14 SER A  55      -67.13   -102.12                                   
REMARK 500 14 THR A  56      -61.89    160.47                                   
REMARK 500 14 TYR A  60      -61.00    -94.25                                   
REMARK 500 14 ASP A  73       57.19   -104.48                                   
REMARK 500 14 ASP A  79      116.43     74.25                                   
REMARK 500 15 ASP A  47      -41.59     65.66                                   
REMARK 500 15 TYR A  60      -67.96    -95.92                                   
REMARK 500 15 ILE A  61       96.76     72.52                                   
REMARK 500 15 ILE A  77      -86.11     68.36                                   
REMARK 500 15 ASP A  78       58.02   -157.76                                   
REMARK 500 15 ASP A  89       67.93   -112.32                                   
REMARK 500 15 GLU A 100      -60.45   -138.27                                   
REMARK 500 15 GLU A 122      -73.36     65.61                                   
REMARK 500 16 LEU A  23       30.43    -85.88                                   
REMARK 500 16 LEU A  74      -61.87     71.63                                   
REMARK 500 16 ILE A  77      -67.81   -101.19                                   
REMARK 500 16 ARG A  80      121.02     82.44                                   
REMARK 500 16 ASP A  89       62.76   -105.23                                   
REMARK 500 16 GLU A 100      -55.25     70.35                                   
REMARK 500 17 SER A  55      -93.41   -116.45                                   
REMARK 500 17 THR A  56      -62.18    176.83                                   
REMARK 500 17 TYR A  60      -76.24   -112.90                                   
REMARK 500 17 ILE A  61       85.51     70.50                                   
REMARK 500 17 LEU A  74     -114.63   -150.26                                   
REMARK 500 17 THR A  75      113.35   -162.63                                   
REMARK 500 17 ILE A  77      -96.04   -130.16                                   
REMARK 500 17 ASP A  79       -1.67   -150.53                                   
REMARK 500 17 ASP A  91      -45.41    126.33                                   
REMARK 500 17 GLN A  97       75.55   -105.95                                   
REMARK 500 18 ASP A  47      -39.02     63.85                                   
REMARK 500 18 PHE A  57      -67.55   -177.14                                   
REMARK 500 18 ILE A  61       95.97     76.20                                   
REMARK 500 18 ILE A  77      -78.99    -80.91                                   
REMARK 500 18 GLU A 100      -58.41   -134.12                                   
REMARK 500 19 ASP A  47      -25.46     64.26                                   
REMARK 500 19 SER A  55      -78.43    -99.08                                   
REMARK 500 19 THR A  56      -61.58    178.58                                   
REMARK 500 19 ASP A  73      -62.38    -90.46                                   
REMARK 500 19 ILE A  77      -69.52   -145.82                                   
REMARK 500 19 ARG A  80      126.21     94.44                                   
REMARK 500 20 PRO A   1     -105.41    -65.19                                   
REMARK 500 20 ASP A  45       75.25   -106.64                                   
REMARK 500 20 ASP A  47      -39.24     81.99                                   
REMARK 500 20 THR A  56       39.35    -74.09                                   
REMARK 500 20 PHE A  57      -65.29   -159.52                                   
REMARK 500 20 ASP A  73      -55.48   -126.46                                   
REMARK 500 20 THR A  75      136.62     87.69                                   
REMARK 500 20 ILE A  77     -162.46   -108.27                                   
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
REMARK 500                                                                      
REMARK 500 GEOMETRY AND STEREOCHEMISTRY                                         
REMARK 500 SUBTOPIC: NON-CIS, NON-TRANS                                         
REMARK 500                                                                      
REMARK 500 THE FOLLOWING PEPTIDE BONDS DEVIATE SIGNIFICANTLY FROM BOTH          
REMARK 500 CIS AND TRANS CONFORMATION.  CIS BONDS, IF ANY, ARE LISTED           
REMARK 500 ON CISPEP RECORDS.  TRANS IS DEFINED AS 180 +/- 30 AND               
REMARK 500 CIS IS DEFINED AS 0 +/- 30 DEGREES.                                  
REMARK 500                                 MODEL     OMEGA                      
REMARK 500 GLU A   72     ASP A   73         10      -139.71                    
REMARK 500 PHE A   70     GLU A   71         13       132.91                    
REMARK 500 GLY A   90     ASP A   91         13       148.32                    
REMARK 500 GLY A   76     ILE A   77         14       140.62                    
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
REMARK 500                                                                      
REMARK 500 GEOMETRY AND STEREOCHEMISTRY                                         
REMARK 500 SUBTOPIC: PLANAR GROUPS                                              
REMARK 500                                                                      
REMARK 500 PLANAR GROUPS IN THE FOLLOWING RESIDUES HAVE A TOTAL                 
REMARK 500 RMS DISTANCE OF ALL ATOMS FROM THE BEST-FIT PLANE                    
REMARK 500 BY MORE THAN AN EXPECTED VALUE OF 6*RMSD, WITH AN                    
REMARK 500 RMSD 0.02 ANGSTROMS, OR AT LEAST ONE ATOM HAS                        
REMARK 500 AN RMSD GREATER THAN THIS VALUE                                      
REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER;               
REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE).                             
REMARK 500                                                                      
REMARK 500  M RES CSSEQI        RMS     TYPE                                    
REMARK 500  3 TYR A  60         0.08    SIDE_CHAIN                              
REMARK 500  7 TYR A  60         0.06    SIDE_CHAIN                              
REMARK 500 13 PHE A  70         0.09    SIDE_CHAIN                              
REMARK 500 16 TYR A  60         0.07    SIDE_CHAIN                              
REMARK 500 17 ARG A 104         0.08    SIDE_CHAIN                              
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
REMARK 900                                                                      
REMARK 900 RELATED ENTRIES                                                      
REMARK 900 RELATED ID: 1KGL   RELATED DB: PDB                                   
REMARK 900 SOLUTION STRUCTURE OF CELLULAR RETINOL BINDING PROTEIN TYPE          
REMARK 900 -I IN COMPLEX WITH ALL-TRANS-RETINOL                                 
REMARK 900 RELATED ID: 1CRB   RELATED DB: PDB                                   
REMARK 900 X-RAY STRUCTURE OF THE CELLULAR RETINOL BINDING PROTEIN              
REMARK 900 TYPE-I IN COMPLEX WITH ALL-TRANS-RETINOL                             
DBREF  1JBH A    0   134  UNP    P02696   RET1_RAT         0    134             
SEQRES   1 A  135  MET PRO VAL ASP PHE ASN GLY TYR TRP LYS MET LEU SER          
SEQRES   2 A  135  ASN GLU ASN PHE GLU GLU TYR LEU ARG ALA LEU ASP VAL          
SEQRES   3 A  135  ASN VAL ALA LEU ARG LYS ILE ALA ASN LEU LEU LYS PRO          
SEQRES   4 A  135  ASP LYS GLU ILE VAL GLN ASP GLY ASP HIS MET ILE ILE          
SEQRES   5 A  135  ARG THR LEU SER THR PHE ARG ASN TYR ILE MET ASP PHE          
SEQRES   6 A  135  GLN VAL GLY LYS GLU PHE GLU GLU ASP LEU THR GLY ILE          
SEQRES   7 A  135  ASP ASP ARG LYS CYS MET THR THR VAL SER TRP ASP GLY          
SEQRES   8 A  135  ASP LYS LEU GLN CYS VAL GLN LYS GLY GLU LYS GLU GLY          
SEQRES   9 A  135  ARG GLY TRP THR GLN TRP ILE GLU GLY ASP GLU LEU HIS          
SEQRES  10 A  135  LEU GLU MET ARG ALA GLU GLY VAL THR CYS LYS GLN VAL          
SEQRES  11 A  135  PHE LYS LYS VAL HIS                                          
HELIX    1   1 PHE A   16  LEU A   23  1                                   8    
HELIX    2   2 VAL A   27  LEU A   35  1                                   9    
SHEET    1   A10 ASN A  59  GLN A  65  0                                        
SHEET    2   A10 HIS A  48  LEU A  54 -1  N  MET A  49   O  PHE A  64           
SHEET    3   A10 ASP A  39  ASP A  45 -1  O  ASP A  39   N  LEU A  54           
SHEET    4   A10 GLY A   6  GLU A  14 -1  O  GLY A   6   N  ILE A  42           
SHEET    5   A10 VAL A 124  LYS A 132 -1  O  VAL A 129   N  LEU A  11           
SHEET    6   A10 GLU A 114  ALA A 121 -1  O  LEU A 115   N  PHE A 130           
SHEET    7   A10 ARG A 104  GLU A 111 -1  N  GLY A 105   O  ARG A 120           
SHEET    8   A10 LYS A  92  LYS A  98 -1  N  LEU A  93   O  GLN A 108           
SHEET    9   A10 CYS A  82  ASP A  89 -1  N  MET A  83   O  LYS A  98           
SHEET   10   A10 LYS A  68  GLU A  71 -1  O  PHE A  70   N  THR A  84           
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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