Header list of 1cek.pdb file
Complete list - 16 202 Bytes
HEADER ACETYLCHOLINE RECEPTOR 09-MAR-99 1CEK TITLE THREE-DIMENSIONAL STRUCTURE OF THE MEMBRANE-EMBEDDED M2 CHANNEL-LINING TITLE 2 SEGMENT FROM THE NICOTINIC ACETYLCHOLINE RECEPTOR BY SOLID-STATE NMR TITLE 3 SPECTROSCOPY COMPND MOL_ID: 1; COMPND 2 MOLECULE: PROTEIN (ACETYLCHOLINE RECEPTOR M2); COMPND 3 CHAIN: A; COMPND 4 FRAGMENT: M2 DOMAIN; COMPND 5 SYNONYM: ACHR M2; COMPND 6 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: RATTUS NORVEGICUS; SOURCE 3 ORGANISM_COMMON: NORWAY RAT; SOURCE 4 ORGANISM_TAXID: 10116; SOURCE 5 ORGAN: BRAIN; SOURCE 6 CELL: NEURON; SOURCE 7 CELLULAR_LOCATION: POST-SYNAPTIC MEMBRANE; SOURCE 8 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21; SOURCE 9 EXPRESSION_SYSTEM_TAXID: 511693; SOURCE 10 EXPRESSION_SYSTEM_STRAIN: BL21; SOURCE 11 EXPRESSION_SYSTEM_VECTOR_TYPE: BACTERIAL; SOURCE 12 EXPRESSION_SYSTEM_PLASMID: PGEX FUSION KEYWDS ACETYLCHOLINE RECEPTOR, M2, LIPID BILAYERS, ION-CHANNEL EXPDTA SOLID-STATE NMR AUTHOR F.M.MARASSI,J.J.GESELL,Y.KIM,A.P.VALENTE,M.OBLATT-MONTAL,M.MONTAL, AUTHOR 2 S.J.OPELLA REVDAT 4 16-FEB-22 1CEK 1 REMARK SEQADV REVDAT 3 24-FEB-09 1CEK 1 VERSN REVDAT 2 09-APR-99 1CEK 1 JRNL REVDAT 1 11-MAR-99 1CEK 0 JRNL AUTH S.J.OPELLA,F.M.MARASSI,J.J.GESELL,A.P.VALENTE,Y.KIM, JRNL AUTH 2 M.OBLATT-MONTAL,M.MONTAL JRNL TITL STRUCTURES OF THE M2 CHANNEL-LINING SEGMENTS FROM NICOTINIC JRNL TITL 2 ACETYLCHOLINE AND NMDA RECEPTORS BY NMR SPECTROSCOPY. JRNL REF NAT.STRUCT.BIOL. V. 6 374 1999 JRNL REFN ISSN 1072-8368 JRNL PMID 10201407 JRNL DOI 10.1038/7610 REMARK 1 REMARK 1 REFERENCE 1 REMARK 1 AUTH F.M.MARASSI,J.J.GESELL,A.P.VALENTE,Y.KIM,M.OBLATT-MONTAL, REMARK 1 AUTH 2 M.MONTAL,S.J.OPELLA REMARK 1 TITL DILUTE SPIN-EXCHANGE ASSIGNMENT OF SOLID-STATE NMR SPECTRA REMARK 1 TITL 2 OF ORIENTED PROTEINS: ACETYLCHOLINE RECEPTOR M2 PEPTIDE IN REMARK 1 TITL 3 BILAYERS REMARK 1 REF TO BE PUBLISHED REMARK 1 REFN REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : FISI, RESTRICT REMARK 3 AUTHORS : NULL REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 1CEK COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB. REMARK 100 THE DEPOSITION ID IS D_1000000606. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 295 REMARK 210 PH : 6.0 REMARK 210 IONIC STRENGTH : NULL REMARK 210 PRESSURE : NULL REMARK 210 SAMPLE CONTENTS : DMPC REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : 15N SHIFT/1H-15N DIPOLAR REMARK 210 COUPLING PISEMA; 15N SHIFT/15N REMARK 210 SHIFT HETCOR; 1H SHIFT/15N SHIFT/ REMARK 210 1H-15N DIPOLAR COUPLING REMARK 210 CORRELATION REMARK 210 SPECTROMETER FIELD STRENGTH : 400 MHZ; 550 MHZ REMARK 210 SPECTROMETER MODEL : HOMEBUILT; CMX400 REMARK 210 SPECTROMETER MANUFACTURER : HOME-BUILT; CHEMAGNETICS REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : BACKTOR, RESTRICT REMARK 210 METHOD USED : ORIENTATIONAL CONSTRAINTS REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : 24 REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1 REMARK 210 CONFORMERS, SELECTION CRITERIA : LOWEST ENERGY REMARK 210 REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : NULL REMARK 210 REMARK 210 REMARK: LOWEST ENERGY. SAMPLE: DMPC BILAYERS ORIENTED ON GLASS REMARK 210 SLIDES 15N CHEMICAL SHIFT, 1H CHEMICAL SHIFT AND 1H-15N DIPOLAR REMARK 210 COUPLING FREQUENCIES WERE MEASURED FROM PISEMA AND REMARK 217 REMARK 217 SOLID STATE NMR STUDY REMARK 217 THE COORDINATES IN THIS ENTRY WERE GENERATED FROM SOLID REMARK 217 STATE NMR DATA. PROTEIN DATA BANK CONVENTIONS REQUIRE THAT REMARK 217 CRYST1 AND SCALE RECORDS BE INCLUDED, BUT THE VALUES ON REMARK 217 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 465 REMARK 465 MISSING RESIDUES REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE REMARK 465 EXPERIMENT. (RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 465 SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) REMARK 465 RES C SSSEQI REMARK 465 GLY A 1 REMARK 465 SER A 2 REMARK 465 GLU A 3 REMARK 465 LYS A 4 REMARK 465 MET A 5 REMARK 465 SER A 6 REMARK 465 THR A 22 REMARK 465 SER A 23 REMARK 465 GLN A 24 REMARK 465 ARG A 25 REMARK 470 REMARK 470 MISSING ATOM REMARK 470 THE FOLLOWING RESIDUES HAVE MISSING ATOMS (RES=RESIDUE NAME; REMARK 470 C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE): REMARK 470 RES CSSEQI ATOMS REMARK 470 THR A 7 N CB OG1 CG2 REMARK 470 ALA A 8 CB REMARK 470 ILE A 9 CB CG1 CG2 CD1 REMARK 470 SER A 10 CB OG REMARK 470 VAL A 11 CB CG1 CG2 REMARK 470 LEU A 12 CB CG CD1 CD2 REMARK 470 LEU A 13 CB CG CD1 CD2 REMARK 470 ALA A 14 CB REMARK 470 GLN A 15 CB CG CD OE1 NE2 REMARK 470 ALA A 16 CB REMARK 470 VAL A 17 CB CG1 CG2 REMARK 470 PHE A 18 CB CG CD1 CD2 CE1 CE2 CZ REMARK 470 LEU A 19 CB CG CD1 CD2 REMARK 470 LEU A 20 CB CG CD1 CD2 REMARK 470 LEU A 21 C O CB CG CD1 CD2 DBREF 1CEK A 1 25 UNP P25110 ACHD_RAT 274 298 SEQADV 1CEK GLY A 1 UNP P25110 CYS 274 CLONING ARTIFACT SEQADV 1CEK SER A 2 UNP P25110 GLY 275 CLONING ARTIFACT SEQADV 1CEK MET A 5 UNP P25110 THR 278 CONFLICT SEQADV 1CEK THR A 7 UNP P25110 VAL 280 CONFLICT SEQADV 1CEK ALA A 16 UNP P25110 SER 289 CONFLICT SEQADV 1CEK THR A 22 UNP P25110 ILE 295 CONFLICT SEQADV 1CEK GLN A 24 UNP P25110 LYS 297 CONFLICT SEQRES 1 A 25 GLY SER GLU LYS MET SER THR ALA ILE SER VAL LEU LEU SEQRES 2 A 25 ALA GLN ALA VAL PHE LEU LEU LEU THR SER GLN ARG HELIX 1 1 THR A 7 LEU A 21 1SEE REMARK 650 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
Complete list - 16 202 Bytes