Header list of 2f4x.pdb file
Complete list - r 9 2 Bytes
HEADER RNA 24-NOV-05 2F4X
TITLE NMR SOLUTION OF HIV-1 LAI KISSING COMPLEX
COMPND MOL_ID: 1;
COMPND 2 MOLECULE: 5'-R(P*GP*GP*UP*UP*GP*CP*UP*GP*AP*AP*GP*CP*GP*CP*GP*CP*AP*C
COMPND 3 P*GP*GP*CP*AP*AP*C)-3';
COMPND 4 CHAIN: A, B;
COMPND 5 ENGINEERED: YES;
COMPND 6 OTHER_DETAILS: HIV-1 LAI PACKAGING SIGNAL
SOURCE MOL_ID: 1;
SOURCE 2 SYNTHETIC: YES;
SOURCE 3 OTHER_DETAILS: RNA WAS PREPARED BY IN VITRO TRANSCRIPTION WITH T7
SOURCE 4 RNA POLYMERASE
KEYWDS SL1, RNA, KISSING COMPLEX, HAIRPIN
EXPDTA SOLUTION NMR
NUMMDL 18
AUTHOR F.KIEKEN,F.PAQUET,F.BRULE,J.PAOLETTI,G.LANCELOT
REVDAT 3 09-MAR-22 2F4X 1 REMARK
REVDAT 2 24-FEB-09 2F4X 1 VERSN
REVDAT 1 28-FEB-06 2F4X 0
JRNL AUTH F.KIEKEN,F.PAQUET,F.BRULE,J.PAOLETTI,G.LANCELOT
JRNL TITL A NEW NMR SOLUTION STRUCTURE OF THE SL1 HIV-1LAI LOOP-LOOP
JRNL TITL 2 DIMER
JRNL REF NUCLEIC ACIDS RES. V. 34 343 2006
JRNL REFN ISSN 0305-1048
JRNL PMID 16410614
JRNL DOI 10.1093/NAR/GKJ427
REMARK 2
REMARK 2 RESOLUTION. NOT APPLICABLE.
REMARK 3
REMARK 3 REFINEMENT.
REMARK 3 PROGRAM : VNMR 6.1B, CNS 1.1
REMARK 3 AUTHORS : VARIAN (VNMR), BRUNGER (CNS)
REMARK 3
REMARK 3 OTHER REFINEMENT REMARKS: NULL
REMARK 4
REMARK 4 2F4X COMPLIES WITH FORMAT V. 3.15, 01-DEC-08
REMARK 100
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 07-DEC-05.
REMARK 100 THE DEPOSITION ID IS D_1000035457.
REMARK 210
REMARK 210 EXPERIMENTAL DETAILS
REMARK 210 EXPERIMENT TYPE : NMR
REMARK 210 TEMPERATURE (KELVIN) : 283; 288
REMARK 210 PH : 6.0; 6.0
REMARK 210 IONIC STRENGTH : NONE; NONE
REMARK 210 PRESSURE : ATMOSPHERIC ATM; ATMOSPHERIC ATM
REMARK 210 SAMPLE CONTENTS : UNLABELED SAMPLE, 2 MM, 90% H2O,
REMARK 210 10% D2O; UNLABELED SAMPLE, 2 MM,
REMARK 210 100% D2O; 15N,13C LABELED SAMPLE,
REMARK 210 0.6 MM, 90% H2O, 10% D2O; 15N,
REMARK 210 13C LABELED SAMPLE, 0.6 MM, 100%
REMARK 210 D2O; MIXTURE OF UNLABELED SAMPLE
REMARK 210 AND A 15N,13C LABELED SAMPLE,
REMARK 210 0.6 MM, 90% H2O, 10% D2O
REMARK 210
REMARK 210 NMR EXPERIMENTS CONDUCTED : 2D NOESY; 2D TOCSY; DQF COSY;
REMARK 210 PFG; HSQC; HCN; HMBC; HCCH TOCSY;
REMARK 210 13C, 15N HALF FILTER
REMARK 210 SPECTROMETER FIELD STRENGTH : 600 MHZ; 800 MHZ
REMARK 210 SPECTROMETER MODEL : UNITY
REMARK 210 SPECTROMETER MANUFACTURER : VARIAN
REMARK 210
REMARK 210 STRUCTURE DETERMINATION.
REMARK 210 SOFTWARE USED : NMRPIPE 5.0.3
REMARK 210 METHOD USED : TORSION ANGLE DYNAMICS AND
REMARK 210 SIMULATED ANNEALING
REMARK 210
REMARK 210 CONFORMERS, NUMBER CALCULATED : 100
REMARK 210 CONFORMERS, NUMBER SUBMITTED : 18
REMARK 210 CONFORMERS, SELECTION CRITERIA : STRUCTURES WITH THE LEAST
REMARK 210 RESTRAINT VIOLATIONS,STRUCTURES
REMARK 210 WITH THE LOWEST 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: 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 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 O2 U B 31 H1 G B 43 1.59
REMARK 500 O2 U A 7 H1 G A 19 1.59
REMARK 500
REMARK 500 REMARK: NULL
DBREF 2F4X A 1 24 PDB 2F4X 2F4X 1 24
DBREF 2F4X B 25 48 PDB 2F4X 2F4X 25 48
SEQRES 1 A 24 G G U U G C U G A A G C G
SEQRES 2 A 24 C G C A C G G C A A C
SEQRES 1 B 24 G G U U G C U G A A G C G
SEQRES 2 B 24 C G C A C G G C A A C
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 - r 9 2 Bytes