Header list of 1whj.pdb file
Complete list - r 2 2 Bytes
HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 28-MAY-04 1WHJ
TITLE SOLUTION STRUCTURE OF THE 1ST CAP-GLY DOMAIN IN MOUSE 1700024K14RIK
TITLE 2 HYPOTHETICAL PROTEIN
COMPND MOL_ID: 1;
COMPND 2 MOLECULE: RIKEN CDNA 1700024K14;
COMPND 3 CHAIN: A;
COMPND 4 FRAGMENT: CAP-GLY DOMAIN;
COMPND 5 SYNONYM: 1700024K14RIK;
COMPND 6 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: RIKEN CDNA 5830409B12;
SOURCE 6 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;
SOURCE 7 EXPRESSION_SYSTEM_PLASMID: P040223-86;
SOURCE 8 OTHER_DETAILS: CELL-FREE PROTEIN SYNTHESIS
KEYWDS STRUCTURAL GENOMICS, RIKEN STRUCTURAL GENOMICS/PROTEOMICS INITIATIVE,
KEYWDS 2 RSGI, UNKNOWN FUNCTION
EXPDTA SOLUTION NMR
NUMMDL 20
AUTHOR K.SAITO,N.TOCHIO,S.KOSHIBA,M.INOUE,T.KIGAWA,S.YOKOYAMA,RIKEN
AUTHOR 2 STRUCTURAL GENOMICS/PROTEOMICS INITIATIVE (RSGI)
REVDAT 3 02-MAR-22 1WHJ 1 REMARK SEQADV
REVDAT 2 24-FEB-09 1WHJ 1 VERSN
REVDAT 1 28-NOV-04 1WHJ 0
JRNL AUTH K.SAITO,N.TOCHIO,S.KOSHIBA,M.INOUE,T.KIGAWA,S.YOKOYAMA
JRNL TITL SOLUTION STRUCTURE OF THE 1ST CAP-GLY DOMAIN IN MOUSE
JRNL TITL 2 1700024K14RIK HYPOTHETICAL PROTEIN
JRNL REF TO BE PUBLISHED
JRNL REFN
REMARK 2
REMARK 2 RESOLUTION. NOT APPLICABLE.
REMARK 3
REMARK 3 REFINEMENT.
REMARK 3 PROGRAM : XWINNMR 3.5, CNS 1.1
REMARK 3 AUTHORS : BRUKER (XWINNMR), BRUNGER, A.T. (CNS)
REMARK 3
REMARK 3 OTHER REFINEMENT REMARKS: NULL
REMARK 4
REMARK 4 1WHJ COMPLIES WITH FORMAT V. 3.15, 01-DEC-08
REMARK 100
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBJ ON 07-JUN-04.
REMARK 100 THE DEPOSITION ID IS D_1000023586.
REMARK 210
REMARK 210 EXPERIMENTAL DETAILS
REMARK 210 EXPERIMENT TYPE : NMR
REMARK 210 TEMPERATURE (KELVIN) : 298
REMARK 210 PH : 7.0
REMARK 210 IONIC STRENGTH : 120MM
REMARK 210 PRESSURE : AMBIENT
REMARK 210 SAMPLE CONTENTS : 1MM PROTEIN, 20MM D-TRIS-HCL, PH
REMARK 210 7.0, 100MM NACL, 1MM D-DTT, 0.02%
REMARK 210 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 : 700 MHZ
REMARK 210 SPECTROMETER MODEL : AVANCE
REMARK 210 SPECTROMETER MANUFACTURER : BRUKER
REMARK 210
REMARK 210 STRUCTURE DETERMINATION.
REMARK 210 SOFTWARE USED : NMRPIPE 20020425, NMRVIEW 5, CNS
REMARK 210 1.1
REMARK 210 METHOD USED : SIMULATED ANNEALING
REMARK 210
REMARK 210 CONFORMERS, NUMBER CALCULATED : 100
REMARK 210 CONFORMERS, NUMBER SUBMITTED : 20
REMARK 210 CONFORMERS, SELECTION CRITERIA : STRUCTURES WITH THE LOWEST
REMARK 210 ENERGY
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 SER A 5 -67.00 -167.76
REMARK 500 1 SER A 6 -73.94 -104.02
REMARK 500 1 LEU A 8 149.83 61.61
REMARK 500 1 SER A 11 -67.84 68.78
REMARK 500 1 HIS A 13 79.12 60.49
REMARK 500 1 THR A 15 32.60 -98.77
REMARK 500 1 GLN A 36 -71.29 -130.49
REMARK 500 1 PRO A 62 81.75 -69.98
REMARK 500 1 GLU A 63 30.89 -141.13
REMARK 500 1 LYS A 65 36.03 -98.22
REMARK 500 1 TYR A 75 -68.09 -121.59
REMARK 500 1 LYS A 95 179.95 60.81
REMARK 500 1 SER A 100 -72.36 67.18
REMARK 500 2 SER A 5 102.28 60.68
REMARK 500 2 SER A 11 -66.90 -136.42
REMARK 500 2 ASP A 12 -73.06 -157.63
REMARK 500 2 ALA A 18 34.79 -96.59
REMARK 500 2 MET A 19 -46.09 -131.69
REMARK 500 2 GLN A 36 -70.88 -142.67
REMARK 500 2 PHE A 49 -46.74 -153.69
REMARK 500 2 PRO A 62 83.71 -68.29
REMARK 500 2 GLU A 63 31.74 -142.32
REMARK 500 2 TYR A 75 -53.15 -141.80
REMARK 500 2 LYS A 95 116.67 -162.56
REMARK 500 2 PRO A 99 -172.46 -69.86
REMARK 500 2 SER A 100 -47.36 -144.98
REMARK 500 2 SER A 101 -68.51 68.52
REMARK 500 3 SER A 3 -51.49 -155.13
REMARK 500 3 THR A 15 -54.48 -136.69
REMARK 500 3 GLN A 36 -65.43 -130.17
REMARK 500 3 PRO A 62 80.00 -64.85
REMARK 500 3 GLU A 63 30.76 -141.03
REMARK 500 3 TYR A 75 -69.88 -130.43
REMARK 500 3 TYR A 82 -47.02 -152.18
REMARK 500 3 ASP A 96 -41.50 -174.18
REMARK 500 4 SER A 2 -63.73 -95.08
REMARK 500 4 SER A 6 -178.19 60.48
REMARK 500 4 LEU A 8 92.82 60.54
REMARK 500 4 SER A 11 150.41 62.27
REMARK 500 4 ASP A 12 91.59 -161.37
REMARK 500 4 HIS A 13 32.31 -99.31
REMARK 500 4 GLN A 36 -67.36 -130.56
REMARK 500 4 PHE A 49 30.51 -152.67
REMARK 500 4 PRO A 62 83.67 -69.96
REMARK 500 4 GLU A 63 30.53 -143.59
REMARK 500 4 TYR A 75 -55.67 -120.72
REMARK 500 4 TYR A 82 -46.57 -134.54
REMARK 500 4 ASP A 96 134.03 63.96
REMARK 500 4 PRO A 99 -179.40 -50.87
REMARK 500 5 SER A 6 -179.80 58.43
REMARK 500
REMARK 500 THIS ENTRY HAS 234 RAMACHANDRAN OUTLIERS.
REMARK 500
REMARK 500 REMARK: NULL
REMARK 900
REMARK 900 RELATED ENTRIES
REMARK 900 RELATED ID: MMT007112333.1 RELATED DB: TARGETDB
DBREF 1WHJ A 8 96 UNP Q8CI96 RSNL2_MOUSE 266 354
SEQADV 1WHJ GLY A 1 UNP Q8CI96 CLONING ARTIFACT
SEQADV 1WHJ SER A 2 UNP Q8CI96 CLONING ARTIFACT
SEQADV 1WHJ SER A 3 UNP Q8CI96 CLONING ARTIFACT
SEQADV 1WHJ GLY A 4 UNP Q8CI96 CLONING ARTIFACT
SEQADV 1WHJ SER A 5 UNP Q8CI96 CLONING ARTIFACT
SEQADV 1WHJ SER A 6 UNP Q8CI96 CLONING ARTIFACT
SEQADV 1WHJ GLY A 7 UNP Q8CI96 CLONING ARTIFACT
SEQADV 1WHJ SER A 97 UNP Q8CI96 CLONING ARTIFACT
SEQADV 1WHJ GLY A 98 UNP Q8CI96 CLONING ARTIFACT
SEQADV 1WHJ PRO A 99 UNP Q8CI96 CLONING ARTIFACT
SEQADV 1WHJ SER A 100 UNP Q8CI96 CLONING ARTIFACT
SEQADV 1WHJ SER A 101 UNP Q8CI96 CLONING ARTIFACT
SEQADV 1WHJ GLY A 102 UNP Q8CI96 CLONING ARTIFACT
SEQRES 1 A 102 GLY SER SER GLY SER SER GLY LEU PRO ASN SER ASP HIS
SEQRES 2 A 102 THR THR SER ARG ALA MET LEU THR SER LEU GLY LEU LYS
SEQRES 3 A 102 LEU GLY ASP ARG VAL VAL ILE ALA GLY GLN LYS VAL GLY
SEQRES 4 A 102 THR LEU ARG PHE CYS GLY THR THR GLU PHE ALA SER GLY
SEQRES 5 A 102 GLN TRP ALA GLY ILE GLU LEU ASP GLU PRO GLU GLY LYS
SEQRES 6 A 102 ASN ASN GLY SER VAL GLY ARG VAL GLN TYR PHE LYS CYS
SEQRES 7 A 102 ALA PRO LYS TYR GLY ILE PHE ALA PRO LEU SER LYS ILE
SEQRES 8 A 102 SER LYS LEU LYS ASP SER GLY PRO SER SER GLY
HELIX 1 1 MET A 19 GLY A 24 1 6
SHEET 1 A 5 GLY A 83 PRO A 87 0
SHEET 2 A 5 GLN A 53 LEU A 59 -1 N ILE A 57 O ILE A 84
SHEET 3 A 5 LYS A 37 THR A 46 -1 N GLY A 45 O TRP A 54
SHEET 4 A 5 ARG A 30 ILE A 33 -1 N VAL A 31 O GLY A 39
SHEET 5 A 5 ILE A 91 LYS A 93 -1 O SER A 92 N VAL A 32
SHEET 1 B 2 SER A 69 VAL A 70 0
SHEET 2 B 2 VAL A 73 GLN A 74 -1 O VAL A 73 N VAL A 70
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