Header list of 1wft.pdb file
Complete list - r 2 2 Bytes
HEADER PROTEIN BINDING 26-MAY-04 1WFT
TITLE SOLUTION STRUCTURE OF C-TERMINAL FIBRONECTIN TYPE III DOMAIN OF MOUSE
TITLE 2 1700129L13RIK PROTEIN
COMPND MOL_ID: 1;
COMPND 2 MOLECULE: 1700129L13RIK PROTEIN;
COMPND 3 CHAIN: A;
COMPND 4 FRAGMENT: FN3 DOMAIN;
COMPND 5 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 1700129L13;
SOURCE 6 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;
SOURCE 7 EXPRESSION_SYSTEM_PLASMID: P031015-19;
SOURCE 8 OTHER_DETAILS: CELL-FREE PROTEIN SYNTHESIS
KEYWDS FN3 DOMAIN, SIMILAR TO HOST CELL FACTOR 2, STRUCTURAL GENOMICS, RIKEN
KEYWDS 2 STRUCTURAL GENOMICS/PROTEOMICS INITIATIVE, RSGI, PROTEIN BINDING
EXPDTA SOLUTION NMR
NUMMDL 20
AUTHOR N.TOCHIO,S.KOSHIBA,M.INOUE,T.KIGAWA,S.YOKOYAMA,RIKEN STRUCTURAL
AUTHOR 2 GENOMICS/PROTEOMICS INITIATIVE (RSGI)
REVDAT 3 02-MAR-22 1WFT 1 REMARK SEQADV
REVDAT 2 24-FEB-09 1WFT 1 VERSN
REVDAT 1 26-NOV-04 1WFT 0
JRNL AUTH N.TOCHIO,S.KOSHIBA,M.INOUE,T.KIGAWA,S.YOKOYAMA
JRNL TITL SOLUTION STRUCTURE OF C-TERMINAL FIBRONECTIN TYPE III DOMAIN
JRNL TITL 2 OF MOUSE 1700129L13RIK PROTEIN
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 1WFT 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 DEPOSITION ID IS D_1000023532.
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 : 220MM
REMARK 210 PRESSURE : AMBIENT
REMARK 210 SAMPLE CONTENTS : 1MM FN3 DOMAIN U-15N, 13C; 20MM
REMARK 210 D-TRIS HCL; 200MM NACL; 2MM D-
REMARK 210 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 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 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 -71.65 -79.08
REMARK 500 1 SER A 6 110.62 -37.36
REMARK 500 1 GLU A 39 156.51 -45.74
REMARK 500 1 PRO A 55 87.64 -69.77
REMARK 500 1 SER A 56 -60.08 -126.77
REMARK 500 1 THR A 69 38.55 -93.04
REMARK 500 1 SER A 70 126.95 -171.73
REMARK 500 1 TYR A 85 34.09 -97.66
REMARK 500 1 PRO A 89 95.77 -69.79
REMARK 500 1 GLU A 100 -65.03 -132.89
REMARK 500 2 SER A 6 82.85 -68.74
REMARK 500 2 PRO A 33 3.08 -69.77
REMARK 500 2 SER A 34 140.14 -34.30
REMARK 500 2 THR A 48 116.89 -160.47
REMARK 500 2 GLN A 57 96.13 -34.62
REMARK 500 2 LEU A 58 135.62 -34.22
REMARK 500 2 SER A 87 -67.21 -92.06
REMARK 500 2 PRO A 89 92.55 -69.68
REMARK 500 2 GLU A 100 -39.27 -35.06
REMARK 500 2 ASN A 115 129.53 -170.99
REMARK 500 3 SER A 3 175.00 -53.00
REMARK 500 3 SER A 5 89.42 -61.23
REMARK 500 3 PRO A 8 -179.74 -69.72
REMARK 500 3 ILE A 37 98.62 -64.76
REMARK 500 3 MET A 51 -62.31 -131.26
REMARK 500 3 GLN A 52 -177.74 -68.99
REMARK 500 3 SER A 56 96.80 -45.18
REMARK 500 3 THR A 69 40.07 -87.74
REMARK 500 3 TYR A 85 42.57 -104.68
REMARK 500 3 PRO A 89 90.51 -69.71
REMARK 500 3 ARG A 94 119.88 -160.24
REMARK 500 4 THR A 31 41.48 -90.46
REMARK 500 4 PRO A 33 86.45 -69.85
REMARK 500 4 MET A 51 101.61 -51.90
REMARK 500 4 ASP A 53 -71.90 -108.19
REMARK 500 4 ASN A 54 158.25 -38.35
REMARK 500 4 LEU A 58 92.41 -43.20
REMARK 500 4 PRO A 89 92.60 -69.74
REMARK 500 5 THR A 31 40.68 -87.58
REMARK 500 5 PRO A 33 2.99 -69.77
REMARK 500 5 ALA A 45 99.44 -67.37
REMARK 500 5 ARG A 47 144.90 -174.19
REMARK 500 5 GLN A 57 101.21 -34.89
REMARK 500 5 LEU A 58 135.07 -38.79
REMARK 500 5 ALA A 81 108.60 -58.28
REMARK 500 5 TYR A 85 30.63 -91.83
REMARK 500 5 PRO A 89 91.98 -69.76
REMARK 500 5 SER A 118 126.65 -35.79
REMARK 500 6 SER A 3 -54.57 -124.03
REMARK 500 6 LEU A 38 -72.29 -38.49
REMARK 500
REMARK 500 THIS ENTRY HAS 228 RAMACHANDRAN OUTLIERS.
REMARK 500
REMARK 500 REMARK: NULL
REMARK 900
REMARK 900 RELATED ENTRIES
REMARK 900 RELATED ID: MMT007015303.1 RELATED DB: TARGETDB
DBREF 1WFT A 8 117 UNP Q9D968 HCFC2_MOUSE 127 236
SEQADV 1WFT GLY A 1 UNP Q9D968 CLONING ARTIFACT
SEQADV 1WFT SER A 2 UNP Q9D968 CLONING ARTIFACT
SEQADV 1WFT SER A 3 UNP Q9D968 CLONING ARTIFACT
SEQADV 1WFT GLY A 4 UNP Q9D968 CLONING ARTIFACT
SEQADV 1WFT SER A 5 UNP Q9D968 CLONING ARTIFACT
SEQADV 1WFT SER A 6 UNP Q9D968 CLONING ARTIFACT
SEQADV 1WFT GLY A 7 UNP Q9D968 CLONING ARTIFACT
SEQADV 1WFT SER A 118 UNP Q9D968 CLONING ARTIFACT
SEQADV 1WFT GLY A 119 UNP Q9D968 CLONING ARTIFACT
SEQADV 1WFT PRO A 120 UNP Q9D968 CLONING ARTIFACT
SEQADV 1WFT SER A 121 UNP Q9D968 CLONING ARTIFACT
SEQADV 1WFT SER A 122 UNP Q9D968 CLONING ARTIFACT
SEQADV 1WFT GLY A 123 UNP Q9D968 CLONING ARTIFACT
SEQRES 1 A 123 GLY SER SER GLY SER SER GLY PRO GLY ALA PRO SER THR
SEQRES 2 A 123 VAL ARG ILE SER LYS ASN VAL ASP GLY ILE HIS LEU SER
SEQRES 3 A 123 TRP GLU PRO PRO THR SER PRO SER GLY ASN ILE LEU GLU
SEQRES 4 A 123 TYR SER ALA TYR LEU ALA ILE ARG THR ALA GLN MET GLN
SEQRES 5 A 123 ASP ASN PRO SER GLN LEU VAL PHE MET ARG ILE TYR CYS
SEQRES 6 A 123 GLY LEU LYS THR SER CYS THR VAL THR ALA GLY GLN LEU
SEQRES 7 A 123 ALA ASN ALA HIS ILE ASP TYR THR SER ARG PRO ALA ILE
SEQRES 8 A 123 VAL PHE ARG ILE SER ALA LYS ASN GLU LYS GLY TYR GLY
SEQRES 9 A 123 PRO ALA THR GLN ILE ARG TRP LEU GLN GLY ASN SER LYS
SEQRES 10 A 123 SER GLY PRO SER SER GLY
HELIX 1 1 ALA A 75 ALA A 79 1 5
SHEET 1 A 3 SER A 12 LYS A 18 0
SHEET 2 A 3 GLY A 22 GLU A 28 -1 O HIS A 24 N SER A 17
SHEET 3 A 3 SER A 70 THR A 74 -1 O VAL A 73 N ILE A 23
SHEET 1 B 4 VAL A 59 GLY A 66 0
SHEET 2 B 4 TYR A 40 ILE A 46 -1 N ALA A 42 O ILE A 63
SHEET 3 B 4 ALA A 90 ALA A 97 -1 O ARG A 94 N TYR A 43
SHEET 4 B 4 THR A 107 LEU A 112 -1 O TRP A 111 N ILE A 91
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