Header list of 1wit.pdb file
Complete list - 2 20 Bytes
HEADER MUSCLE PROTEIN 23-JUN-96 1WIT
TITLE TWITCHIN IMMUNOGLOBULIN SUPERFAMILY DOMAIN (IGSF MODULE) (IG 18'),
TITLE 2 NMR, MINIMIZED AVERAGE STRUCTURE
COMPND MOL_ID: 1;
COMPND 2 MOLECULE: TWITCHIN 18TH IGSF MODULE;
COMPND 3 CHAIN: A;
COMPND 4 ENGINEERED: YES
SOURCE MOL_ID: 1;
SOURCE 2 ORGANISM_SCIENTIFIC: CAENORHABDITIS ELEGANS;
SOURCE 3 ORGANISM_TAXID: 6239;
SOURCE 4 ORGAN: BODY WALL MUSCLE;
SOURCE 5 TISSUE: MUSCLE A-BAND;
SOURCE 6 CELL: MUSCLE CELL;
SOURCE 7 GENE: UNC-22;
SOURCE 8 EXPRESSION_SYSTEM: ESCHERICHIA COLI;
SOURCE 9 EXPRESSION_SYSTEM_TAXID: 562;
SOURCE 10 EXPRESSION_SYSTEM_STRAIN: JM 109;
SOURCE 11 EXPRESSION_SYSTEM_PLASMID: PRSETC (INVITROGEN);
SOURCE 12 EXPRESSION_SYSTEM_GENE: UNC-22
KEYWDS IMMUNOGLOBULIN SUPERFAMILY, I SET, MUSCLE PROTEIN
EXPDTA SOLUTION NMR
AUTHOR S.FONG,M.BYCROFT
REVDAT 3 02-MAR-22 1WIT 1 REMARK
REVDAT 2 24-FEB-09 1WIT 1 VERSN
REVDAT 1 23-DEC-96 1WIT 0
JRNL AUTH S.FONG,S.J.HAMILL,M.PROCTOR,S.M.FREUND,G.M.BENIAN,C.CHOTHIA,
JRNL AUTH 2 M.BYCROFT,J.CLARKE
JRNL TITL STRUCTURE AND STABILITY OF AN IMMUNOGLOBULIN SUPERFAMILY
JRNL TITL 2 DOMAIN FROM TWITCHIN, A MUSCLE PROTEIN OF THE NEMATODE
JRNL TITL 3 CAENORHABDITIS ELEGANS.
JRNL REF J.MOL.BIOL. V. 264 624 1996
JRNL REFN ISSN 0022-2836
JRNL PMID 8969309
JRNL DOI 10.1006/JMBI.1996.0665
REMARK 1
REMARK 1 REFERENCE 1
REMARK 1 AUTH G.M.BENIAN,S.W.L'HERNAULT,M.E.MORRIS
REMARK 1 TITL ADDITIONAL SEQUENCE COMPLEXITY IN THE MUSCLE GENE, UNC-22,
REMARK 1 TITL 2 AND ITS ENCODED PROTEIN, TWITCHIN, OF CAENORHABDITIS ELEGANS
REMARK 1 REF GENETICS V. 134 1097 1993
REMARK 1 REFN ISSN 0016-6731
REMARK 1 REFERENCE 2
REMARK 1 AUTH G.M.BENIAN,J.E.KIFF,N.NECKELMANN,D.G.MOERMAN,R.H.WATERSTON
REMARK 1 TITL SEQUENCE OF AN UNUSUALLY LARGE PROTEIN IMPLICATED IN
REMARK 1 TITL 2 REGULATION OF MYOSIN ACTIVITY IN C. ELEGANS
REMARK 1 REF NATURE V. 342 45 1989
REMARK 1 REFN ISSN 0028-0836
REMARK 2
REMARK 2 RESOLUTION. NOT APPLICABLE.
REMARK 3
REMARK 3 REFINEMENT.
REMARK 3 PROGRAM : X-PLOR 3.1
REMARK 3 AUTHORS : BRUNGER
REMARK 3
REMARK 3 OTHER REFINEMENT REMARKS: NULL
REMARK 4
REMARK 4 1WIT COMPLIES WITH FORMAT V. 3.30, 13-JUL-11
REMARK 100
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY BNL.
REMARK 100 THE DEPOSITION ID IS D_1000177204.
REMARK 210
REMARK 210 EXPERIMENTAL DETAILS
REMARK 210 EXPERIMENT TYPE : NMR
REMARK 210 TEMPERATURE (KELVIN) : NULL
REMARK 210 PH : NULL
REMARK 210 IONIC STRENGTH : NULL
REMARK 210 PRESSURE : NULL
REMARK 210 SAMPLE CONTENTS : NULL
REMARK 210
REMARK 210 NMR EXPERIMENTS CONDUCTED : NULL
REMARK 210 SPECTROMETER FIELD STRENGTH : NULL
REMARK 210 SPECTROMETER MODEL : NULL
REMARK 210 SPECTROMETER MANUFACTURER : NULL
REMARK 210
REMARK 210 STRUCTURE DETERMINATION.
REMARK 210 SOFTWARE USED : NULL
REMARK 210 METHOD USED : NULL
REMARK 210
REMARK 210 CONFORMERS, NUMBER CALCULATED : NULL
REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1
REMARK 210 CONFORMERS, SELECTION CRITERIA : MINIMIZED AVERAGE
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 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 LYS A 4 79.08 -100.05
REMARK 500 THR A 7 120.30 -38.92
REMARK 500 SER A 9 121.55 59.50
REMARK 500 ARG A 10 -82.65 -167.58
REMARK 500 ALA A 29 167.93 176.09
REMARK 500 ASP A 31 84.72 34.85
REMARK 500 PRO A 32 -167.86 -78.62
REMARK 500 ALA A 46 -52.83 165.21
REMARK 500 LEU A 49 -164.08 176.61
REMARK 500 THR A 57 -168.07 -178.64
REMARK 500 THR A 58 154.33 178.31
REMARK 500 PHE A 62 46.16 -141.59
REMARK 500 SER A 70 92.79 -46.41
REMARK 500 ASN A 79 89.12 -176.48
REMARK 500 GLU A 80 -83.13 64.91
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 ARG A 10 0.29 SIDE CHAIN
REMARK 500 ARG A 67 0.08 SIDE CHAIN
REMARK 500
REMARK 500 REMARK: NULL
REMARK 900
REMARK 900 RELATED ENTRIES
REMARK 900 RELATED ID: 1WIU RELATED DB: PDB
DBREF 1WIT A 1 93 UNP Q23551 Q23551_CAEEL 5001 5093
SEQRES 1 A 93 LEU LYS PRO LYS ILE LEU THR ALA SER ARG LYS ILE LYS
SEQRES 2 A 93 ILE LYS ALA GLY PHE THR HIS ASN LEU GLU VAL ASP PHE
SEQRES 3 A 93 ILE GLY ALA PRO ASP PRO THR ALA THR TRP THR VAL GLY
SEQRES 4 A 93 ASP SER GLY ALA ALA LEU ALA PRO GLU LEU LEU VAL ASP
SEQRES 5 A 93 ALA LYS SER SER THR THR SER ILE PHE PHE PRO SER ALA
SEQRES 6 A 93 LYS ARG ALA ASP SER GLY ASN TYR LYS LEU LYS VAL LYS
SEQRES 7 A 93 ASN GLU LEU GLY GLU ASP GLU ALA ILE PHE GLU VAL ILE
SEQRES 8 A 93 VAL GLN
HELIX 1 1 ARG A 67 ASP A 69 5 3
SHEET 1 S1 4 LYS A 4 LEU A 6 0
SHEET 2 S1 4 HIS A 20 ILE A 27 -1 N ILE A 27 O LYS A 4
SHEET 3 S1 4 THR A 57 PHE A 62 -1 N ILE A 60 O LEU A 22
SHEET 4 S1 4 LEU A 50 LYS A 54 -1 N ASP A 52 O SER A 59
SHEET 1 S2 5 ARG A 10 ILE A 14 0
SHEET 2 S2 5 GLY A 82 GLN A 93 1 N ILE A 91 O ILE A 12
SHEET 3 S2 5 GLY A 71 ASN A 79 -1 N LEU A 75 O ALA A 86
SHEET 4 S2 5 THR A 33 THR A 37 -1 N THR A 35 O LYS A 76
SHEET 5 S2 5 ALA A 44 LEU A 45 -1 N LEU A 45 O TRP A 36
CISPEP 1 ALA A 29 PRO A 30 0 0.91
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
Complete list - 2 20 Bytes