Header list of 1z65.pdb file
Complete list - 2 20 Bytes
HEADER UNKNOWN FUNCTION 21-MAR-05 1Z65
TITLE MOUSE DOPPEL 1-30 PEPTIDE
COMPND MOL_ID: 1;
COMPND 2 MOLECULE: PRION-LIKE PROTEIN DOPPEL;
COMPND 3 CHAIN: A;
COMPND 4 FRAGMENT: RESIDUES 1-30;
COMPND 5 SYNONYM: PRPLP; DOPPELGANGER;
COMPND 6 ENGINEERED: YES
SOURCE MOL_ID: 1;
SOURCE 2 SYNTHETIC: YES;
SOURCE 3 OTHER_DETAILS: SEQUENCE APPEARS NATURALLY IN MUS MUSCULUS, GENE PRND
KEYWDS TRANSMEMBRANE HELIX; DHPC; MOUSE DOPPEL, UNKNOWN FUNCTION
EXPDTA SOLUTION NMR
NUMMDL 22
AUTHOR E.PAPADOPOULOS
REVDAT 4 02-MAR-22 1Z65 1 REMARK
REVDAT 3 24-FEB-09 1Z65 1 VERSN
REVDAT 2 14-FEB-06 1Z65 1 JRNL
REVDAT 1 07-FEB-06 1Z65 0
JRNL AUTH E.PAPADOPOULOS,K.OGLECKA,L.MALER,J.JARVET,P.E.WRIGHT,
JRNL AUTH 2 H.J.DYSON,A.GRASLUND
JRNL TITL NMR SOLUTION STRUCTURE OF THE PEPTIDE FRAGMENT 1-30, DERIVED
JRNL TITL 2 FROM UNPROCESSED MOUSE DOPPEL PROTEIN, IN DHPC MICELLES
JRNL REF BIOCHEMISTRY V. 45 159 2006
JRNL REFN ISSN 0006-2960
JRNL PMID 16388591
JRNL DOI 10.1021/BI051313F
REMARK 2
REMARK 2 RESOLUTION. NOT APPLICABLE.
REMARK 3
REMARK 3 REFINEMENT.
REMARK 3 PROGRAM : DYANA 1.5
REMARK 3 AUTHORS : NULL
REMARK 3
REMARK 3 OTHER REFINEMENT REMARKS: NULL
REMARK 4
REMARK 4 1Z65 COMPLIES WITH FORMAT V. 3.15, 01-DEC-08
REMARK 100
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 31-MAR-05.
REMARK 100 THE DEPOSITION ID IS D_1000032346.
REMARK 210
REMARK 210 EXPERIMENTAL DETAILS
REMARK 210 EXPERIMENT TYPE : NMR
REMARK 210 TEMPERATURE (KELVIN) : 318
REMARK 210 PH : 3.5
REMARK 210 IONIC STRENGTH : UNKNOWN
REMARK 210 PRESSURE : AMBIENT
REMARK 210 SAMPLE CONTENTS : 2 MM MOUSE DOPPEL 1-30 PEPTIDE
REMARK 210
REMARK 210 NMR EXPERIMENTS CONDUCTED : 2D NOESY; 2D TOCSY
REMARK 210 SPECTROMETER FIELD STRENGTH : 800 MHZ
REMARK 210 SPECTROMETER MODEL : INOVA
REMARK 210 SPECTROMETER MANUFACTURER : VARIAN
REMARK 210
REMARK 210 STRUCTURE DETERMINATION.
REMARK 210 SOFTWARE USED : FELIX 2000.1, DYANA 1.5
REMARK 210 METHOD USED : NULL
REMARK 210
REMARK 210 CONFORMERS, NUMBER CALCULATED : 50
REMARK 210 CONFORMERS, NUMBER SUBMITTED : 22
REMARK 210 CONFORMERS, SELECTION CRITERIA : STRUCTURES WITH FAVORABLE NON
REMARK 210 -BOND 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: CLOSE CONTACTS
REMARK 500
REMARK 500 THE FOLLOWING ATOMS ARE IN CLOSE CONTACT.
REMARK 500
REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI DISTANCE
REMARK 500 O ILE A 12 H LEU A 16 1.56
REMARK 500
REMARK 500 REMARK: NULL
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 LYS A 2 84.96 50.64
REMARK 500 1 ASN A 3 -65.88 -154.66
REMARK 500 1 LEU A 5 -170.73 -54.60
REMARK 500 1 ALA A 18 -79.49 -40.02
REMARK 500 1 SER A 22 -89.92 -144.69
REMARK 500 1 ALA A 26 77.51 -172.77
REMARK 500 1 ILE A 29 169.60 54.83
REMARK 500 2 LYS A 2 55.64 -174.96
REMARK 500 2 ASN A 3 -45.03 169.96
REMARK 500 2 SER A 22 -95.40 -147.83
REMARK 500 2 ALA A 26 67.77 178.67
REMARK 500 2 ILE A 29 -97.49 -49.72
REMARK 500 3 LYS A 2 78.66 -157.24
REMARK 500 3 ALA A 18 -76.17 -40.47
REMARK 500 3 SER A 22 -83.08 -150.35
REMARK 500 3 LYS A 25 -176.17 -54.76
REMARK 500 3 ARG A 27 -96.91 -58.92
REMARK 500 4 ASN A 3 -65.11 69.83
REMARK 500 4 ARG A 4 -92.90 -62.18
REMARK 500 4 LEU A 5 173.09 -49.99
REMARK 500 4 THR A 7 -44.34 -160.74
REMARK 500 4 ALA A 18 -72.77 -40.30
REMARK 500 4 SER A 22 -60.08 -157.65
REMARK 500 4 ALA A 26 -3.83 82.10
REMARK 500 4 ILE A 29 93.32 56.30
REMARK 500 5 LYS A 2 50.86 -160.53
REMARK 500 5 ASN A 3 -52.21 -167.98
REMARK 500 5 LEU A 5 159.77 -47.17
REMARK 500 5 THR A 7 -42.04 -174.51
REMARK 500 5 ALA A 18 -70.16 -39.83
REMARK 500 5 SER A 22 -67.48 -160.57
REMARK 500 5 LYS A 25 164.06 -43.55
REMARK 500 5 ALA A 26 65.42 170.63
REMARK 500 6 LEU A 5 -84.28 -163.28
REMARK 500 6 THR A 7 -44.97 -164.62
REMARK 500 6 LEU A 21 52.76 -119.74
REMARK 500 6 SER A 22 -67.52 -159.81
REMARK 500 6 ALA A 26 68.12 60.22
REMARK 500 6 ILE A 29 -105.33 63.54
REMARK 500 7 LYS A 2 66.68 -161.85
REMARK 500 7 SER A 22 -69.44 -160.02
REMARK 500 7 ALA A 26 59.16 -175.61
REMARK 500 8 THR A 7 -47.48 -160.41
REMARK 500 8 SER A 22 -74.63 -140.72
REMARK 500 8 ALA A 26 -58.24 -174.87
REMARK 500 8 ILE A 29 -103.22 66.39
REMARK 500 9 ARG A 4 -92.98 -166.99
REMARK 500 9 LEU A 5 -140.55 76.79
REMARK 500 9 ALA A 18 -79.27 -40.30
REMARK 500 9 SER A 22 -61.20 -150.71
REMARK 500
REMARK 500 THIS ENTRY HAS 141 RAMACHANDRAN OUTLIERS.
REMARK 500
REMARK 500 REMARK: NULL
DBREF 1Z65 A 1 30 UNP Q9QUG3 PRND_MOUSE 1 30
SEQRES 1 A 30 MET LYS ASN ARG LEU GLY THR TRP TRP VAL ALA ILE LEU
SEQRES 2 A 30 CYS MET LEU LEU ALA SER HIS LEU SER THR VAL LYS ALA
SEQRES 3 A 30 ARG GLY ILE LYS
HELIX 1 1 THR A 7 LEU A 21 1 15
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