Header list of 1x2v.pdb file
Complete list - 2 202 Bytes
HEADER DNA 26-APR-05 1X2V
TITLE NMR SOLUTION STRUCTURES OF A DNA DODECAMER CONTAINING A TANDEM GT
TITLE 2 MISMATCHES USING NOE AND RESIDUAL DIPOLAR COUPLINGS
COMPND MOL_ID: 1;
COMPND 2 MOLECULE: 5'-D(*GP*AP*CP*TP*GP*TP*AP*CP*AP*GP*TP*C)-3';
COMPND 3 CHAIN: A, B;
COMPND 4 ENGINEERED: YES
SOURCE MOL_ID: 1;
SOURCE 2 SYNTHETIC: YES
KEYWDS RDC, DEOXYRIBONUCLEIC ACID, LIQUID CRYSTAL, DNA
EXPDTA SOLUTION NMR
AUTHOR F.ALVAREZ-SALGADO,H.DESVAUX,Y.BOULARD
REVDAT 4 02-MAR-22 1X2V 1 REMARK
REVDAT 3 24-FEB-09 1X2V 1 VERSN
REVDAT 2 05-DEC-06 1X2V 1 JRNL
REVDAT 1 01-AUG-06 1X2V 0
JRNL AUTH F.ALVAREZ-SALGADO,H.DESVAUX,Y.BOULARD
JRNL TITL NMR ASSESSMENT OF THE GLOBAL SHAPE OF A NON-LABELLED DNA
JRNL TITL 2 DODECAMER CONTAINING A TANDEM OF G--T MISMATCHES
JRNL REF MAGN.RESON.CHEM. V. 44 1081 2006
JRNL REFN ISSN 0749-1581
JRNL PMID 16972306
JRNL DOI 10.1002/MRC.1902
REMARK 2
REMARK 2 RESOLUTION. NOT APPLICABLE.
REMARK 3
REMARK 3 REFINEMENT.
REMARK 3 PROGRAM : CNS 1.1
REMARK 3 AUTHORS : BRUNGER,ADAMS,CLORE,DELANO,GROS,GROSSE
REMARK 3 -KUNSTLEVE,JIANG,KUSZEWSKI,NILGES, PANNU,READ,RICE,
REMARK 3 SIMONSON,WARREN
REMARK 3
REMARK 3 OTHER REFINEMENT REMARKS: NULL
REMARK 4
REMARK 4 1X2V COMPLIES WITH FORMAT V. 3.30, 13-JUL-11
REMARK 100
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBJ ON 27-APR-05.
REMARK 100 THE DEPOSITION ID IS D_1000024309.
REMARK 210
REMARK 210 EXPERIMENTAL DETAILS
REMARK 210 EXPERIMENT TYPE : NMR
REMARK 210 TEMPERATURE (KELVIN) : 298
REMARK 210 PH : 7.0
REMARK 210 IONIC STRENGTH : 10MM PHOSPHATE BUFFER, 50MM
REMARK 210 NACL, 0.2MM EDTA
REMARK 210 PRESSURE : AMBIENT
REMARK 210 SAMPLE CONTENTS : 0.5MM DNA, 10MM PHOSPHATE
REMARK 210 BUFFER, 50MM NACL, 0.5MM EDTA
REMARK 210
REMARK 210 NMR EXPERIMENTS CONDUCTED : NOESY; COSY; TOCSY; HSQC 1H-13C
REMARK 210 SPECTROMETER FIELD STRENGTH : 800 MHZ; 600 MHZ; 500 MHZ
REMARK 210 SPECTROMETER MODEL : AVANCE
REMARK 210 SPECTROMETER MANUFACTURER : BRUKER
REMARK 210
REMARK 210 STRUCTURE DETERMINATION.
REMARK 210 SOFTWARE USED : XWINNMR 2.5, CURVES 5.3, MOLMOL
REMARK 210 2.6
REMARK 210 METHOD USED : SIMULATED ANNEALING, ENERGY
REMARK 210 MINIMIZATION
REMARK 210
REMARK 210 CONFORMERS, NUMBER CALCULATED : NULL
REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1
REMARK 210 CONFORMERS, SELECTION CRITERIA : NULL
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: DIMERIC
REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, B
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 900
REMARK 900 RELATED ENTRIES
REMARK 900 RELATED ID: 1X2O RELATED DB: PDB
REMARK 900 RDCS WERE MEASURED IN BICELLES SDS SOLUTION
REMARK 900 RELATED ID: 1X2S RELATED DB: PDB
REMARK 900 RDCS WERE MEASURED IN PF1 SOLUTION
REMARK 900 RELATED ID: 1X2U RELATED DB: PDB
REMARK 900 RDCS WERE MEASURED IN PEG SOLUTION
REMARK 900 RELATED ID: 1X2X RELATED DB: PDB
REMARK 900 RDCS WERE MEASURED IN BICELLES SDS SOLUTION, A TANDEM GT MISMATCHES
REMARK 900 RELATED ID: 1X2Y RELATED DB: PDB
REMARK 900 RDCS WERE MEASURED IN PF1 SOLUTION, A TANDEM GT MISMATCHES
REMARK 900 RELATED ID: 1X2Z RELATED DB: PDB
REMARK 900 RDCS WERE MEASURED IN PEG SOLUTION, A TANDEM GT MISMATCHES
REMARK 900 RELATED ID: 1X30 RELATED DB: PDB
REMARK 900 THIS STRUCTURE CONTAINS A TANDEM GT MISMATCHES
DBREF 1X2V A 1 12 PDB 1X2V 1X2V 1 12
DBREF 1X2V B 13 24 PDB 1X2V 1X2V 13 24
SEQRES 1 A 12 DG DA DC DT DG DT DA DC DA DG DT DC
SEQRES 1 B 12 DG DA DC DT DG DT DA DC DA DG DT DC
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 - 2 202 Bytes