Header list of 1wjo.pdb file
Complete list - r 2 2 Bytes
HEADER PROTEIN BINDING 29-MAY-04 1WJO
TITLE SOLUTION STRUCTURE OF THE FORTH CH DOMAIN FROM HUMAN PLASTIN 3 T-
TITLE 2 ISOFORM
COMPND MOL_ID: 1;
COMPND 2 MOLECULE: T-PLASTIN;
COMPND 3 CHAIN: A;
COMPND 4 FRAGMENT: CH DOMAIN;
COMPND 5 SYNONYM: PLASTIN 3 T-ISOFORM;
COMPND 6 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: IMS CDNA HEP01557;
SOURCE 6 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;
SOURCE 7 EXPRESSION_SYSTEM_PLASMID: P040223-07;
SOURCE 8 OTHER_DETAILS: CELL-FREE PROTEIN SYNTHESIS
KEYWDS CH DOMAIN, ACTIN BINDING, PLASTIN 3, STRUCTURAL GENOMICS, RIKEN
KEYWDS 2 STRUCTURAL GENOMICS/PROTEOMICS INITIATIVE, RSGI, PROTEIN BINDING
EXPDTA SOLUTION NMR
NUMMDL 20
AUTHOR T.TOMIZAWA,T.KIGAWA,S.KOSHIBA,M.INOUE,S.YOKOYAMA,RIKEN STRUCTURAL
AUTHOR 2 GENOMICS/PROTEOMICS INITIATIVE (RSGI)
REVDAT 3 02-MAR-22 1WJO 1 REMARK SEQADV
REVDAT 2 24-FEB-09 1WJO 1 VERSN
REVDAT 1 29-NOV-04 1WJO 0
JRNL AUTH T.TOMIZAWA,T.KIGAWA,S.KOSHIBA,M.INOUE,S.YOKOYAMA
JRNL TITL SOLUTION STRUCTURE OF THE FORTH CH DOMAIN FROM HUMAN PLASTIN
JRNL TITL 2 3 T-ISOFORM
JRNL REF TO BE PUBLISHED
JRNL REFN
REMARK 2
REMARK 2 RESOLUTION. NOT APPLICABLE.
REMARK 3
REMARK 3 REFINEMENT.
REMARK 3 PROGRAM : XWINNMR 2.6, CYANA 2.0.17
REMARK 3 AUTHORS : BRUKER (XWINNMR), GUENTERT, P. (CYANA)
REMARK 3
REMARK 3 OTHER REFINEMENT REMARKS: NULL
REMARK 4
REMARK 4 1WJO COMPLIES WITH FORMAT V. 3.15, 01-DEC-08
REMARK 100
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBJ ON 09-JUN-04.
REMARK 100 THE DEPOSITION ID IS D_1000023648.
REMARK 210
REMARK 210 EXPERIMENTAL DETAILS
REMARK 210 EXPERIMENT TYPE : NMR
REMARK 210 TEMPERATURE (KELVIN) : 296
REMARK 210 PH : 7.0
REMARK 210 IONIC STRENGTH : 120MM
REMARK 210 PRESSURE : AMBIENT
REMARK 210 SAMPLE CONTENTS : 1.16MM CH DOMAIN U-15N,13C; 20MM
REMARK 210 D-TRIS-HCL(PH 7.0); 100MM NACL;
REMARK 210 1MM D-DTT; 0.02% NAN3; 10% D2O
REMARK 210
REMARK 210 NMR EXPERIMENTS CONDUCTED : 3D_13C-SEPARATED_NOESY; 3D_15N
REMARK 210 -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 : NMRPIPE 20030801, NMRVIEW 5.0.4,
REMARK 210 KUJIRA 0.901, 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, STRUCTURES
REMARK 210 WITH THE LOWEST ENERGY, 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 300
REMARK 300 BIOMOLECULE: 1
REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM
REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN
REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON
REMARK 300 BURIED SURFACE AREA.
REMARK 350
REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN
REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE
REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS
REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND
REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN.
REMARK 350
REMARK 350 BIOMOLECULE: 1
REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC
REMARK 350 APPLY THE FOLLOWING TO CHAINS: A
REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000
REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000
REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000
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 ASP A 58 -36.02 -38.56
REMARK 500 1 ARG A 87 42.48 37.51
REMARK 500 2 ASP A 58 -37.85 -39.46
REMARK 500 2 GLU A 67 -31.15 -37.73
REMARK 500 2 ASP A 68 -73.19 -84.12
REMARK 500 2 VAL A 78 -71.99 -55.93
REMARK 500 2 TYR A 89 48.41 35.33
REMARK 500 2 PRO A 100 1.81 -69.76
REMARK 500 2 LYS A 116 135.55 -37.39
REMARK 500 3 ASP A 9 -53.62 -127.35
REMARK 500 3 SER A 26 30.48 -96.77
REMARK 500 3 SER A 28 148.32 -170.79
REMARK 500 3 ASP A 34 150.55 -46.19
REMARK 500 3 ASP A 58 -34.29 -39.66
REMARK 500 3 TYR A 89 39.06 -84.51
REMARK 500 3 LEU A 91 150.84 -47.74
REMARK 500 3 MET A 115 110.82 -34.86
REMARK 500 3 SER A 122 95.34 -39.07
REMARK 500 4 SER A 5 161.72 -45.95
REMARK 500 4 ASN A 8 66.72 -108.14
REMARK 500 4 ASP A 9 -61.63 -98.94
REMARK 500 4 TYR A 89 37.57 -85.92
REMARK 500 4 PRO A 121 92.26 -69.78
REMARK 500 5 ASP A 9 -59.69 -125.53
REMARK 500 5 GLU A 22 -39.96 -36.87
REMARK 500 5 SER A 31 -176.39 -170.11
REMARK 500 5 ASP A 34 156.71 -43.17
REMARK 500 5 ASP A 58 -33.83 -38.76
REMARK 500 5 GLU A 67 -37.11 -36.87
REMARK 500 5 ALA A 86 101.06 -35.13
REMARK 500 5 TYR A 89 46.01 35.01
REMARK 500 5 LEU A 91 143.99 -38.02
REMARK 500 5 SER A 122 48.95 -92.54
REMARK 500 6 SER A 3 102.38 -54.58
REMARK 500 6 ASN A 8 -71.00 -84.64
REMARK 500 6 ASP A 9 -62.42 -128.37
REMARK 500 6 SER A 28 146.55 -172.56
REMARK 500 6 ASP A 58 -31.98 -36.91
REMARK 500 6 GLU A 67 -36.71 -36.83
REMARK 500 6 VAL A 88 107.08 -39.62
REMARK 500 6 PRO A 100 2.56 -69.74
REMARK 500 6 MET A 102 -33.70 -133.42
REMARK 500 6 CYS A 109 -32.16 -36.53
REMARK 500 6 MET A 115 103.06 -41.76
REMARK 500 6 LYS A 116 80.63 -60.63
REMARK 500 7 SER A 5 145.29 -34.72
REMARK 500 7 GLU A 22 -35.74 -39.13
REMARK 500 7 ASP A 58 -33.68 -38.79
REMARK 500 7 ASN A 64 86.63 -69.84
REMARK 500 7 GLU A 67 -38.14 -38.81
REMARK 500
REMARK 500 THIS ENTRY HAS 153 RAMACHANDRAN OUTLIERS.
REMARK 500
REMARK 500 REMARK: NULL
REMARK 900
REMARK 900 RELATED ENTRIES
REMARK 900 RELATED ID: HSS001001434.1 RELATED DB: TARGETDB
DBREF 1WJO A 8 118 UNP P13797 PLST_HUMAN 517 627
SEQADV 1WJO GLY A 1 UNP P13797 CLONING ARTIFACT
SEQADV 1WJO SER A 2 UNP P13797 CLONING ARTIFACT
SEQADV 1WJO SER A 3 UNP P13797 CLONING ARTIFACT
SEQADV 1WJO GLY A 4 UNP P13797 CLONING ARTIFACT
SEQADV 1WJO SER A 5 UNP P13797 CLONING ARTIFACT
SEQADV 1WJO SER A 6 UNP P13797 CLONING ARTIFACT
SEQADV 1WJO GLY A 7 UNP P13797 CLONING ARTIFACT
SEQADV 1WJO SER A 119 UNP P13797 CLONING ARTIFACT
SEQADV 1WJO GLY A 120 UNP P13797 CLONING ARTIFACT
SEQADV 1WJO PRO A 121 UNP P13797 CLONING ARTIFACT
SEQADV 1WJO SER A 122 UNP P13797 CLONING ARTIFACT
SEQADV 1WJO SER A 123 UNP P13797 CLONING ARTIFACT
SEQADV 1WJO GLY A 124 UNP P13797 CLONING ARTIFACT
SEQRES 1 A 124 GLY SER SER GLY SER SER GLY ASN ASP ASP ILE ILE VAL
SEQRES 2 A 124 ASN TRP VAL ASN ARG THR LEU SER GLU ALA GLY LYS SER
SEQRES 3 A 124 THR SER ILE GLN SER PHE LYS ASP LYS THR ILE SER SER
SEQRES 4 A 124 SER LEU ALA VAL VAL ASP LEU ILE ASP ALA ILE GLN PRO
SEQRES 5 A 124 GLY CYS ILE ASN TYR ASP LEU VAL LYS SER GLY ASN LEU
SEQRES 6 A 124 THR GLU ASP ASP LYS HIS ASN ASN ALA LYS TYR ALA VAL
SEQRES 7 A 124 SER MET ALA ARG ARG ILE GLY ALA ARG VAL TYR ALA LEU
SEQRES 8 A 124 PRO GLU ASP LEU VAL GLU VAL LYS PRO LYS MET VAL MET
SEQRES 9 A 124 THR VAL PHE ALA CYS LEU MET GLY ARG GLY MET LYS ARG
SEQRES 10 A 124 VAL SER GLY PRO SER SER GLY
HELIX 1 1 ASP A 9 GLY A 24 1 16
HELIX 2 2 THR A 36 SER A 39 5 4
HELIX 3 3 SER A 40 GLN A 51 1 12
HELIX 4 4 THR A 66 ILE A 84 1 19
HELIX 5 5 LEU A 91 VAL A 98 1 8
HELIX 6 6 MET A 104 GLY A 114 1 11
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
Complete list - r 2 2 Bytes