Header list of 1v46.pdb file
Complete list - 2 20 Bytes
HEADER NEUROPEPTIDE 10-NOV-03 1V46
TITLE SOLUTION STRUCTURE OF CCAP (CRUSTACEAN CARDIOACTIVE PEPTIDE) FROM
TITLE 2 DROSOPHILA MELANOGASTER
COMPND MOL_ID: 1;
COMPND 2 MOLECULE: CARDIOACTIVE PEPTIDE;
COMPND 3 CHAIN: A;
COMPND 4 SYNONYM: CCAP;
COMPND 5 ENGINEERED: YES
SOURCE MOL_ID: 1;
SOURCE 2 SYNTHETIC: YES;
SOURCE 3 OTHER_DETAILS: THIS SEQUENCE OCCURS NATURALLY IN DROSOPHILA
SOURCE 4 MELANOGASTER.
KEYWDS NEUROPEPTIDE
EXPDTA SOLUTION NMR
NUMMDL 10
AUTHOR K.NAGATA,M.TANOKURA
REVDAT 3 02-MAR-22 1V46 1 REMARK
REVDAT 2 24-FEB-09 1V46 1 VERSN
REVDAT 1 14-DEC-04 1V46 0
JRNL AUTH K.NAGATA,M.TANOKURA
JRNL TITL SOLUTION STRUCTURE OF CCAP FROM DROSOPHILA MELANOGASTER
JRNL REF TO BE PUBLISHED
JRNL REFN
REMARK 2
REMARK 2 RESOLUTION. NOT APPLICABLE.
REMARK 3
REMARK 3 REFINEMENT.
REMARK 3 PROGRAM : VNMR 6.1C, DYANA 1.4
REMARK 3 AUTHORS : VARIAN, INC. (VNMR), GUENTERT, P. (DYANA)
REMARK 3
REMARK 3 OTHER REFINEMENT REMARKS: THE STRUCTURES ARE BASED ON A TOTAL OF
REMARK 3 79 RESTRAINTS, OF WHICH 65 ARE NOE-DERIVED DISTANCE RESTRAINTS,
REMARK 3 8 DIHEDRAL ANGLE RESTRAINTS, AND 6 DISTANCE RESTRAINTS FOR THE
REMARK 3 DISULFIDE BOND (CYS3-CYS9).
REMARK 4
REMARK 4 1V46 COMPLIES WITH FORMAT V. 3.15, 01-DEC-08
REMARK 100
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBJ ON 12-NOV-03.
REMARK 100 THE DEPOSITION ID IS D_1000006183.
REMARK 210
REMARK 210 EXPERIMENTAL DETAILS
REMARK 210 EXPERIMENT TYPE : NMR
REMARK 210 TEMPERATURE (KELVIN) : 298
REMARK 210 PH : 6.0
REMARK 210 IONIC STRENGTH : ALMOST ZERO
REMARK 210 PRESSURE : AMBIENT
REMARK 210 SAMPLE CONTENTS : 5MM CCAP; DMSO-D6
REMARK 210
REMARK 210 NMR EXPERIMENTS CONDUCTED : 2D NOESY; 2D TOCSY; DQF-COSY; E
REMARK 210 -COSY
REMARK 210 SPECTROMETER FIELD STRENGTH : 500 MHZ
REMARK 210 SPECTROMETER MODEL : INOVA
REMARK 210 SPECTROMETER MANUFACTURER : VARIAN
REMARK 210
REMARK 210 STRUCTURE DETERMINATION.
REMARK 210 SOFTWARE USED : NMRPIPE 2002.113.19.37, SPARKY
REMARK 210 3.106, DYANA 1.4
REMARK 210 METHOD USED : TORSION ANGLE DYNAMICS USING
REMARK 210 DYANA VER. 1.4
REMARK 210
REMARK 210 CONFORMERS, NUMBER CALCULATED : 100
REMARK 210 CONFORMERS, NUMBER SUBMITTED : 10
REMARK 210 CONFORMERS, SELECTION CRITERIA : TARGET FUNCTION
REMARK 210
REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : NULL
REMARK 210
REMARK 210 REMARK: THIS STRUCTURE WAS DETERMINED USING STANDARD 2D
REMARK 210 HOMONUCLEAR TECHNIQUES.
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 PHE A 2 155.27 -42.30
REMARK 500 1 CYS A 3 157.64 -43.44
REMARK 500 1 PHE A 6 -6.77 166.14
REMARK 500 1 THR A 7 -69.87 -90.56
REMARK 500 2 PHE A 2 155.44 -42.45
REMARK 500 2 CYS A 3 157.71 -43.59
REMARK 500 2 PHE A 6 -6.99 166.15
REMARK 500 2 THR A 7 -69.86 -90.50
REMARK 500 3 PHE A 2 155.08 -42.22
REMARK 500 3 CYS A 3 157.76 -43.59
REMARK 500 3 PHE A 6 -6.78 166.22
REMARK 500 3 THR A 7 -69.85 -90.62
REMARK 500 4 PHE A 2 154.98 -42.21
REMARK 500 4 CYS A 3 157.44 -43.50
REMARK 500 4 PHE A 6 -6.76 166.17
REMARK 500 4 THR A 7 -69.68 -90.64
REMARK 500 5 PHE A 2 155.40 -42.34
REMARK 500 5 CYS A 3 157.60 -43.51
REMARK 500 5 PHE A 6 -6.77 166.13
REMARK 500 5 THR A 7 -69.79 -90.52
REMARK 500 6 PHE A 2 154.99 -42.21
REMARK 500 6 CYS A 3 157.58 -43.53
REMARK 500 6 PHE A 6 -6.63 166.10
REMARK 500 6 THR A 7 -69.52 -90.65
REMARK 500 7 PHE A 2 154.79 -42.05
REMARK 500 7 CYS A 3 157.49 -43.52
REMARK 500 7 PHE A 6 -6.71 166.10
REMARK 500 7 THR A 7 -69.59 -90.58
REMARK 500 8 PHE A 2 154.88 -42.09
REMARK 500 8 CYS A 3 157.65 -43.55
REMARK 500 8 PHE A 6 -6.89 166.25
REMARK 500 8 THR A 7 -69.78 -90.59
REMARK 500 9 PHE A 2 155.27 -42.30
REMARK 500 9 CYS A 3 157.78 -43.65
REMARK 500 9 PHE A 6 -6.95 166.14
REMARK 500 9 THR A 7 -69.90 -90.55
REMARK 500 10 PHE A 2 154.71 -42.03
REMARK 500 10 CYS A 3 157.44 -43.43
REMARK 500 10 PHE A 6 -6.65 166.17
REMARK 500 10 THR A 7 -69.58 -90.64
REMARK 500
REMARK 500 REMARK: NULL
REMARK 900
REMARK 900 RELATED ENTRIES
REMARK 900 RELATED ID: 9053 RELATED DB: BMRB
DBREF 1V46 A 1 9 GB 21355713 NP_651083 48 56
SEQRES 1 A 9 PRO PHE CYS ASN ALA PHE THR GLY CYS
SSBOND 1 CYS A 3 CYS A 9 1555 1555 2.10
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 - 2 20 Bytes