Header list of 1ap7.pdb file
Complete list - b 16 2 Bytes
HEADER CELL CYCLE INHIBITOR 25-JUL-97 1AP7
TITLE P19-INK4D FROM MOUSE, NMR, 20 STRUCTURES
COMPND MOL_ID: 1;
COMPND 2 MOLECULE: P19-INK4D;
COMPND 3 CHAIN: A;
COMPND 4 SYNONYM: CYCLIN DEPENDENT KINASE 4 INHIBITOR D;
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 CELL_LINE: BL21;
SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3);
SOURCE 7 EXPRESSION_SYSTEM_TAXID: 469008;
SOURCE 8 EXPRESSION_SYSTEM_STRAIN: BL21 (DE3);
SOURCE 9 EXPRESSION_SYSTEM_VECTOR_TYPE: FUSED TO 5' END OF GLUTATHIONE-S-
SOURCE 10 TRANSFERASE GENE;
SOURCE 11 EXPRESSION_SYSTEM_VECTOR: PGEX 2T;
SOURCE 12 EXPRESSION_SYSTEM_PLASMID: BL21
KEYWDS CELL CYCLE INHIBITOR, CYCLIN DEPENDENT KINASE INHIBITOR, INK, CDKI,
KEYWDS 2 ANKYRIN REPEAT
EXPDTA SOLUTION NMR
NUMMDL 20
AUTHOR S.J.ARCHER,F.Y.LUH,P.J.DOMAILLE,B.O.SMITH,E.D.LAUE
REVDAT 3 16-FEB-22 1AP7 1 REMARK SEQADV
REVDAT 2 24-FEB-09 1AP7 1 VERSN
REVDAT 1 16-SEP-98 1AP7 0
JRNL AUTH F.Y.LUH,S.J.ARCHER,P.J.DOMAILLE,B.O.SMITH,D.OWEN,
JRNL AUTH 2 D.H.BROTHERTON,A.R.RAINE,X.XU,L.BRIZUELA,S.L.BRENNER,
JRNL AUTH 3 E.D.LAUE
JRNL TITL STRUCTURE OF THE CYCLIN-DEPENDENT KINASE INHIBITOR P19INK4D.
JRNL REF NATURE V. 389 999 1997
JRNL REFN ISSN 0028-0836
JRNL PMID 9353127
JRNL DOI 10.1038/40202
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: REFINEMENT DETAILS CAN BE FOUND IN THE
REMARK 3 JRNL CITATION ABOVE.
REMARK 4
REMARK 4 1AP7 COMPLIES WITH FORMAT V. 3.15, 01-DEC-08
REMARK 100
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY BNL.
REMARK 100 THE DEPOSITION ID IS D_1000171087.
REMARK 210
REMARK 210 EXPERIMENTAL DETAILS
REMARK 210 EXPERIMENT TYPE : NMR
REMARK 210 TEMPERATURE (KELVIN) : 303
REMARK 210 PH : 7.5
REMARK 210 IONIC STRENGTH : 100MM NACL, 1MM EDTA, 5MM DTT
REMARK 210 PRESSURE : 1 ATM
REMARK 210 SAMPLE CONTENTS : 20MM SODIUM PHOSPHATE
REMARK 210
REMARK 210 NMR EXPERIMENTS CONDUCTED : 3D N13 NOESY; 4D N15 NOESY; 3D
REMARK 210 C13 NOESY; 4D C13 NOESY; 3D HNHA
REMARK 210 SPECTROMETER FIELD STRENGTH : 600 MHZ
REMARK 210 SPECTROMETER MODEL : AMX600
REMARK 210 SPECTROMETER MANUFACTURER : BRUKER
REMARK 210
REMARK 210 STRUCTURE DETERMINATION.
REMARK 210 SOFTWARE USED : AZARA, ANSIG, XPLOR, PIPP,
REMARK 210 NMRPIPE
REMARK 210 METHOD USED : XPLOR SA WITH AMBIGUOUS
REMARK 210 RESTRAINTS
REMARK 210
REMARK 210 CONFORMERS, NUMBER CALCULATED : 30
REMARK 210 CONFORMERS, NUMBER SUBMITTED : 20
REMARK 210 CONFORMERS, SELECTION CRITERIA : LOWEST ENERGY STRUCTURES WITH NO
REMARK 210 VIOLATIONS
REMARK 210
REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : 1
REMARK 210
REMARK 210 REMARK: THE STRUCTURE WAS DETERMINED USING TRIPLE-RESONANCE NMR
REMARK 210 SPECTROSCOPY ON 13C, 15N-LABELED P19INK4D. ADDITIONAL RESTRAINTS
REMARK 210 WERE DETERMINED FROM NMR ON 2H, 15N-LABELED P19INK4D AND
REMARK 210 SELECTIVELY LABELED P19INK4D.
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
DBREF 1AP7 A 3 168 UNP Q60773 CDN2D_MOUSE 1 166
SEQADV 1AP7 ALA A 18 UNP Q60773 ARG 16 CONFLICT
SEQRES 1 A 168 GLY SER MET LEU LEU GLU GLU VAL CYS VAL GLY ASP ARG
SEQRES 2 A 168 LEU SER GLY ALA ALA ALA ARG GLY ASP VAL GLN GLU VAL
SEQRES 3 A 168 ARG ARG LEU LEU HIS ARG GLU LEU VAL HIS PRO ASP ALA
SEQRES 4 A 168 LEU ASN ARG PHE GLY LYS THR ALA LEU GLN VAL MET MET
SEQRES 5 A 168 PHE GLY SER PRO ALA VAL ALA LEU GLU LEU LEU LYS GLN
SEQRES 6 A 168 GLY ALA SER PRO ASN VAL GLN ASP ALA SER GLY THR SER
SEQRES 7 A 168 PRO VAL HIS ASP ALA ALA ARG THR GLY PHE LEU ASP THR
SEQRES 8 A 168 LEU LYS VAL LEU VAL GLU HIS GLY ALA ASP VAL ASN ALA
SEQRES 9 A 168 LEU ASP SER THR GLY SER LEU PRO ILE HIS LEU ALA ILE
SEQRES 10 A 168 ARG GLU GLY HIS SER SER VAL VAL SER PHE LEU ALA PRO
SEQRES 11 A 168 GLU SER ASP LEU HIS HIS ARG ASP ALA SER GLY LEU THR
SEQRES 12 A 168 PRO LEU GLU LEU ALA ARG GLN ARG GLY ALA GLN ASN LEU
SEQRES 13 A 168 MET ASP ILE LEU GLN GLY HIS MET MET ILE PRO MET
HELIX 1 1 GLY A 11 ARG A 20 1 10
HELIX 2 2 VAL A 23 HIS A 31 1 9
HELIX 3 3 ALA A 47 VAL A 50 1 4
HELIX 4 4 PRO A 56 GLN A 65 1 10
HELIX 5 5 PRO A 79 THR A 86 1 8
HELIX 6 6 LEU A 89 HIS A 98 1 10
HELIX 7 7 PRO A 112 GLU A 119 1 8
HELIX 8 8 SER A 123 PRO A 130 1 8
HELIX 9 9 PRO A 144 GLN A 150 1 7
HELIX 10 10 LEU A 156 MET A 164 1 9
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 - b 16 2 Bytes