Header list of 1wx7.pdb file
Complete list - r 2 2 Bytes
HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 20-JAN-05 1WX7
TITLE SOLUTION STRUCTURE OF THE N-TERMINAL UBIQUITIN-LIKE DOMAIN IN THE
TITLE 2 HUMAN UBIQUILIN 3 (UBQLN3)
COMPND MOL_ID: 1;
COMPND 2 MOLECULE: UBIQUILIN 3;
COMPND 3 CHAIN: A;
COMPND 4 FRAGMENT: UBIQUITIN-LIKE FOLD;
COMPND 5 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: UBQLN3;
SOURCE 6 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;
SOURCE 7 EXPRESSION_SYSTEM_PLASMID: P040517-10;
SOURCE 8 OTHER_DETAILS: CELL-FREE PROTEIN SYNTHESIS
KEYWDS HUMAN UBIQUILIN 3 (UBQLN3), UBIQUITIN-LIKE DOMAIN, STRUCTURAL
KEYWDS 2 GENOMICS, RIKEN STRUCTURAL GENOMICS/PROTEOMICS INITIATIVE, RSGI,
KEYWDS 3 UNKNOWN FUNCTION
EXPDTA SOLUTION NMR
NUMMDL 20
AUTHOR C.ZHAO,K.SAITO,S.KOSHIBA,M.INOUE,T.KIGAWA,S.YOKOYAMA,RIKEN STRUCTURAL
AUTHOR 2 GENOMICS/PROTEOMICS INITIATIVE (RSGI)
REVDAT 3 02-MAR-22 1WX7 1 REMARK SEQADV
REVDAT 2 24-FEB-09 1WX7 1 VERSN
REVDAT 1 20-JUL-05 1WX7 0
JRNL AUTH C.ZHAO,K.SAITO,S.KOSHIBA,M.INOUE,T.KIGAWA,S.YOKOYAMA
JRNL TITL SOLUTION STRUCTURE OF THE N-TERMINAL UBIQUITIN-LIKE DOMAIN
JRNL TITL 2 IN THE HUMAN UBIQUILIN 3 (UBQLN3)
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 1WX7 COMPLIES WITH FORMAT V. 3.15, 01-DEC-08
REMARK 100
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBJ ON 21-JAN-05.
REMARK 100 THE DEPOSITION ID IS D_1000024107.
REMARK 210
REMARK 210 EXPERIMENTAL DETAILS
REMARK 210 EXPERIMENT TYPE : NMR
REMARK 210 TEMPERATURE (KELVIN) : 298.0
REMARK 210 PH : 7.0
REMARK 210 IONIC STRENGTH : 100MM
REMARK 210 PRESSURE : AMBIENT
REMARK 210 SAMPLE CONTENTS : 2.0MM PROTEIN U-15N, 13C/20MM D
REMARK 210 -TRIS-HCL (PH7.0), 100MM NACL,
REMARK 210 1MM D-DTT, 0.02% NAN3, 10% D2O
REMARK 210
REMARK 210 NMR EXPERIMENTS CONDUCTED : 3D_15N-SEPARATED_NOESY; 3D_13C
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 20020425, NMRVIEW 5.0.4,
REMARK 210 KUJIRA 0.921, 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 : TARGET FUNCTION,STRUCTURES WITH
REMARK 210 THE LEAST RESTRAINT VIOLATIONS
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 95.39 -61.45
REMARK 500 1 PRO A 9 -173.83 -69.81
REMARK 500 1 PRO A 15 -91.54 -69.73
REMARK 500 1 PRO A 25 4.34 -69.76
REMARK 500 1 PRO A 69 4.04 -69.80
REMARK 500 1 GLN A 90 48.33 -101.78
REMARK 500 1 ARG A 92 74.38 -110.89
REMARK 500 1 SER A 105 144.24 -39.49
REMARK 500 2 SER A 6 109.86 -36.37
REMARK 500 2 PRO A 15 -90.85 -69.72
REMARK 500 2 LEU A 17 103.82 -46.00
REMARK 500 2 PRO A 25 4.36 -69.67
REMARK 500 2 PRO A 69 4.52 -69.77
REMARK 500 2 HIS A 91 117.79 -165.04
REMARK 500 2 GLU A 97 81.03 -64.80
REMARK 500 2 SER A 105 85.86 -69.68
REMARK 500 3 PRO A 15 -90.84 -69.77
REMARK 500 3 LEU A 17 102.73 -56.34
REMARK 500 3 PRO A 25 4.38 -69.81
REMARK 500 3 PRO A 69 3.89 -69.80
REMARK 500 3 ARG A 92 46.06 34.78
REMARK 500 3 PRO A 99 2.37 -69.70
REMARK 500 3 SER A 101 -63.01 -97.15
REMARK 500 4 PRO A 15 -90.86 -69.78
REMARK 500 4 LEU A 17 104.40 -56.98
REMARK 500 4 PRO A 25 4.73 -69.79
REMARK 500 4 PRO A 54 0.40 -69.70
REMARK 500 4 PRO A 69 4.22 -69.73
REMARK 500 4 ALA A 93 97.05 -36.87
REMARK 500 4 MET A 94 127.31 -174.53
REMARK 500 4 GLU A 97 38.18 -91.62
REMARK 500 4 PRO A 99 -179.98 -69.79
REMARK 500 4 ALA A 100 44.97 -84.66
REMARK 500 5 SER A 8 143.18 -171.10
REMARK 500 5 ALA A 10 145.78 -171.26
REMARK 500 5 VAL A 12 149.54 -33.17
REMARK 500 5 GLN A 13 152.88 -35.56
REMARK 500 5 PRO A 15 -90.89 -69.81
REMARK 500 5 LEU A 17 102.50 -59.13
REMARK 500 5 PRO A 25 3.75 -69.77
REMARK 500 5 PRO A 69 4.24 -69.75
REMARK 500 5 PRO A 99 95.21 -69.70
REMARK 500 6 SER A 8 78.41 -109.20
REMARK 500 6 GLN A 13 179.17 -50.35
REMARK 500 6 PRO A 15 -90.87 -69.76
REMARK 500 6 LEU A 17 104.71 -57.52
REMARK 500 6 PRO A 25 3.65 -69.75
REMARK 500 6 PRO A 69 4.23 -69.72
REMARK 500 6 ASN A 96 113.12 -170.80
REMARK 500 6 ALA A 100 128.59 -171.37
REMARK 500
REMARK 500 THIS ENTRY HAS 150 RAMACHANDRAN OUTLIERS.
REMARK 500
REMARK 500 REMARK: NULL
REMARK 650
REMARK 650 HELIX
REMARK 650 DETERMINATION METHOD: AUTHOR DETERMINED
REMARK 900
REMARK 900 RELATED ENTRIES
REMARK 900 RELATED ID: HSS001004043.1 RELATED DB: TARGETDB
DBREF 1WX7 A 8 100 UNP Q9H347 UBQL3_HUMAN 12 104
SEQADV 1WX7 GLY A 1 UNP Q9H347 CLONING ARTIFACT
SEQADV 1WX7 SER A 2 UNP Q9H347 CLONING ARTIFACT
SEQADV 1WX7 SER A 3 UNP Q9H347 CLONING ARTIFACT
SEQADV 1WX7 GLY A 4 UNP Q9H347 CLONING ARTIFACT
SEQADV 1WX7 SER A 5 UNP Q9H347 CLONING ARTIFACT
SEQADV 1WX7 SER A 6 UNP Q9H347 CLONING ARTIFACT
SEQADV 1WX7 GLY A 7 UNP Q9H347 CLONING ARTIFACT
SEQADV 1WX7 SER A 101 UNP Q9H347 CLONING ARTIFACT
SEQADV 1WX7 GLY A 102 UNP Q9H347 CLONING ARTIFACT
SEQADV 1WX7 PRO A 103 UNP Q9H347 CLONING ARTIFACT
SEQADV 1WX7 SER A 104 UNP Q9H347 CLONING ARTIFACT
SEQADV 1WX7 SER A 105 UNP Q9H347 CLONING ARTIFACT
SEQADV 1WX7 GLY A 106 UNP Q9H347 CLONING ARTIFACT
SEQRES 1 A 106 GLY SER SER GLY SER SER GLY SER PRO ALA PRO VAL GLN
SEQRES 2 A 106 ASP PRO HIS LEU ILE LYS VAL THR VAL LYS THR PRO LYS
SEQRES 3 A 106 ASP LYS GLU ASP PHE SER VAL THR ASP THR CYS THR ILE
SEQRES 4 A 106 GLN GLN LEU LYS GLU GLU ILE SER GLN ARG PHE LYS ALA
SEQRES 5 A 106 HIS PRO ASP GLN LEU VAL LEU ILE PHE ALA GLY LYS ILE
SEQRES 6 A 106 LEU LYS ASP PRO ASP SER LEU ALA GLN CYS GLY VAL ARG
SEQRES 7 A 106 ASP GLY LEU THR VAL HIS LEU VAL ILE LYS ARG GLN HIS
SEQRES 8 A 106 ARG ALA MET GLY ASN GLU CYS PRO ALA SER GLY PRO SER
SEQRES 9 A 106 SER GLY
HELIX 1 1 ILE A 39 ARG A 49 1 11
HELIX 2 2 LEU A 72 CYS A 75 1 4
SHEET 1 A 5 LYS A 28 THR A 34 0
SHEET 2 A 5 LEU A 17 LYS A 23 -1 N VAL A 22 O GLU A 29
SHEET 3 A 5 LEU A 81 ILE A 87 1 O VAL A 83 N THR A 21
SHEET 4 A 5 LEU A 57 PHE A 61 -1 N VAL A 58 O VAL A 86
SHEET 5 A 5 LYS A 64 ILE A 65 -1 O LYS A 64 N PHE A 61
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