Header list of 2ap0.pdb file
Complete list - r 9 2 Bytes
HEADER RNA 15-AUG-05 2AP0
TITLE SOLUTION STRUCTURE OF THE C27A SCYLV P1-P2 FRAMESHIFTING PSEUDOKNOT,
TITLE 2 20 LOWEST ENERGY STRUCTURES
COMPND MOL_ID: 1;
COMPND 2 MOLECULE: C27A SUGARCANE YELLOW LEAF VIRUS RNA PSEUDOKNOT;
COMPND 3 CHAIN: A;
COMPND 4 ENGINEERED: YES
SOURCE MOL_ID: 1;
SOURCE 2 SYNTHETIC: YES;
SOURCE 3 OTHER_DETAILS: MUTANT OF NATURALLY OCCURING RNA FRAGMENT THAT FORMS
SOURCE 4 AN RNA PSEUDOKNOT IN SUGARCANE YELLOW LEAF VIRUS
KEYWDS RNA PSEUDOKNOT; FRAMESHIFTING, RNA
EXPDTA SOLUTION NMR
NUMMDL 20
AUTHOR P.V.CORNISH,D.P.GIEDROC
REVDAT 5 09-MAR-22 2AP0 1 REMARK LINK
REVDAT 4 24-FEB-09 2AP0 1 VERSN
REVDAT 3 28-NOV-06 2AP0 1 JRNL
REVDAT 2 10-OCT-06 2AP0 1 JRNL
REVDAT 1 05-SEP-06 2AP0 0
JRNL AUTH P.V.CORNISH,S.N.STAMMLER,D.P.GIEDROC
JRNL TITL THE GLOBAL STRUCTURES OF A WILD-TYPE AND POORLY FUNCTIONAL
JRNL TITL 2 PLANT LUTEOVIRAL MRNA PSEUDOKNOT ARE ESSENTIALLY IDENTICAL
JRNL REF RNA V. 12 1959 2006
JRNL REFN ISSN 1355-8382
JRNL PMID 17000902
JRNL DOI 10.1261/RNA.199006
REMARK 2
REMARK 2 RESOLUTION. NOT APPLICABLE.
REMARK 3
REMARK 3 REFINEMENT.
REMARK 3 PROGRAM : NMRPIPE MAC OS X VERSION, XPLOR-NIH 2.10
REMARK 3 AUTHORS : F. DELAGLIO, S. GRZESIEK, G. W. VUISTER, G. ZHU,
REMARK 3 J. PFEIFER AND A. BAX (NMRPIPE), G. MARIUS CLORE ,
REMARK 3 JOHN KUSZEWSKI, CHARLES D. SCHWIETERS, AND NICO
REMARK 3 TJANDRA (XPLOR-NIH)
REMARK 3
REMARK 3 OTHER REFINEMENT REMARKS: NULL
REMARK 4
REMARK 4 2AP0 COMPLIES WITH FORMAT V. 3.15, 01-DEC-08
REMARK 100
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 19-SEP-05.
REMARK 100 THE DEPOSITION ID IS D_1000034149.
REMARK 210
REMARK 210 EXPERIMENTAL DETAILS
REMARK 210 EXPERIMENT TYPE : NMR
REMARK 210 TEMPERATURE (KELVIN) : 283; 298
REMARK 210 PH : 6.0; 6.0
REMARK 210 IONIC STRENGTH : 100MM KCL, 5MM MGCL2; 100MM KCL,
REMARK 210 5MM MGCL2
REMARK 210 PRESSURE : AMBIENT; AMBIENT
REMARK 210 SAMPLE CONTENTS : 2.7MM C27A SCYLV; 100MM KCL; 5MM
REMARK 210 MGCL2; 2.7MM C27A SCYLV; 100MM
REMARK 210 KCL; 5MM MGCL2; 2.7MM C27A SCYLV;
REMARK 210 100MM KCL; 5MM MGCL2; 15 MG/ML
REMARK 210 PF1 PHAGE
REMARK 210
REMARK 210 NMR EXPERIMENTS CONDUCTED : 2D NOESY; 2D TOCSY; TROSY
REMARK 210 SPECTROMETER FIELD STRENGTH : 500 MHZ
REMARK 210 SPECTROMETER MODEL : INOVA
REMARK 210 SPECTROMETER MANUFACTURER : VARIAN
REMARK 210
REMARK 210 STRUCTURE DETERMINATION.
REMARK 210 SOFTWARE USED : SPARKY 3
REMARK 210 METHOD USED : SIMULATED ANNEALING STARTING
REMARK 210 WITH RANDOM COORDINATES FOLLOWED
REMARK 210 BY REFINEMENT WITH RESIDUAL
REMARK 210 DIPOLAR COUPLINGS
REMARK 210
REMARK 210 CONFORMERS, NUMBER CALCULATED : 20
REMARK 210 CONFORMERS, NUMBER SUBMITTED : 20
REMARK 210 CONFORMERS, SELECTION CRITERIA : STRUCTURES WITH THE LEAST
REMARK 210 RESTRAINT VIOLATIONS
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 H22 G A 6 H61 A A 23 1.35
REMARK 500 O2' A A 20 H5'' A A 21 1.49
REMARK 500 H2' G A 4 O4' U A 5 1.52
REMARK 500
REMARK 500 REMARK: NULL
REMARK 500
REMARK 500 GEOMETRY AND STEREOCHEMISTRY
REMARK 500 SUBTOPIC: COVALENT BOND LENGTHS
REMARK 500
REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES
REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE
REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN
REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE).
REMARK 500
REMARK 500 STANDARD TABLE:
REMARK 500 FORMAT: (10X,I3,1X,2(A3,1X,A1,I4,A1,1X,A4,3X),1X,F6.3)
REMARK 500
REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999
REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996
REMARK 500
REMARK 500 M RES CSSEQI ATM1 RES CSSEQI ATM2 DEVIATION
REMARK 500 1 C A 14 C2' C A 14 C1' -0.053
REMARK 500 1 C A 15 C2' C A 15 C1' -0.048
REMARK 500 1 U A 18 C2' U A 18 C1' -0.080
REMARK 500 2 G A 7 C2' G A 7 C1' -0.076
REMARK 500 2 C A 14 C2' C A 14 C1' -0.052
REMARK 500 2 U A 18 C2' U A 18 C1' -0.087
REMARK 500 3 G A 7 C2' G A 7 C1' -0.059
REMARK 500 3 G A 7 O3' G A 7 C3' 0.074
REMARK 500 3 C A 10 C2' C A 10 C1' -0.050
REMARK 500 3 G A 12 N7 G A 12 C8 -0.042
REMARK 500 3 C A 14 C2' C A 14 C1' -0.100
REMARK 500 3 C A 15 C2' C A 15 C1' -0.057
REMARK 500 3 U A 18 C2' U A 18 C1' -0.101
REMARK 500 4 G A 4 C2' G A 4 C1' -0.048
REMARK 500 4 C A 14 C2' C A 14 C1' -0.052
REMARK 500 4 U A 18 C2' U A 18 C1' -0.076
REMARK 500 4 U A 19 C2' U A 19 C1' -0.092
REMARK 500 4 U A 19 O4' U A 19 C4' -0.082
REMARK 500 4 U A 19 N1 U A 19 C6 -0.056
REMARK 500 5 G A 4 C2' G A 4 C1' -0.064
REMARK 500 5 U A 5 C2' U A 5 C1' -0.107
REMARK 500 5 G A 6 C5' G A 6 C4' 0.099
REMARK 500 5 G A 6 C2' G A 6 C1' -0.063
REMARK 500 5 G A 6 O4' G A 6 C1' 0.075
REMARK 500 5 G A 6 C2 G A 6 N3 0.050
REMARK 500 5 G A 6 C5 G A 6 N7 -0.037
REMARK 500 5 G A 6 N7 G A 6 C8 -0.036
REMARK 500 5 G A 6 C8 G A 6 N9 -0.068
REMARK 500 5 G A 6 N9 G A 6 C4 0.051
REMARK 500 5 C A 14 C2' C A 14 C1' -0.099
REMARK 500 5 C A 15 C5' C A 15 C4' 0.082
REMARK 500 5 U A 18 C2' U A 18 C1' -0.099
REMARK 500 6 C A 14 C2' C A 14 C1' -0.057
REMARK 500 6 U A 18 C2' U A 18 C1' -0.097
REMARK 500 7 C A 14 C2' C A 14 C1' -0.058
REMARK 500 7 C A 15 C2' C A 15 C1' -0.054
REMARK 500 7 U A 18 C2' U A 18 C1' -0.098
REMARK 500 7 U A 19 C5' U A 19 C4' 0.082
REMARK 500 8 G A 4 C2' G A 4 C1' -0.077
REMARK 500 8 U A 5 C5' U A 5 C4' 0.077
REMARK 500 8 C A 14 C2' C A 14 C1' -0.052
REMARK 500 8 U A 18 C2' U A 18 C1' -0.105
REMARK 500 9 C A 10 C2' C A 10 C1' -0.049
REMARK 500 9 C A 14 C2' C A 14 C1' -0.104
REMARK 500 9 C A 15 C2' C A 15 C1' -0.049
REMARK 500 9 A A 16 C2' A A 16 C1' -0.048
REMARK 500 9 U A 18 C2' U A 18 C1' -0.096
REMARK 500 10 G A 7 C2' G A 7 C1' -0.071
REMARK 500 10 G A 12 N7 G A 12 C8 -0.036
REMARK 500 10 C A 14 C2' C A 14 C1' -0.049
REMARK 500
REMARK 500 THIS ENTRY HAS 109 BOND DEVIATIONS.
REMARK 500
REMARK 500 REMARK: NULL
REMARK 500
REMARK 500 GEOMETRY AND STEREOCHEMISTRY
REMARK 500 SUBTOPIC: COVALENT BOND ANGLES
REMARK 500
REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES
REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE
REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN
REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE).
REMARK 500
REMARK 500 STANDARD TABLE:
REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1)
REMARK 500
REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999
REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996
REMARK 500
REMARK 500 M RES CSSEQI ATM1 ATM2 ATM3
REMARK 500 1 A A 3 N7 - C8 - N9 ANGL. DEV. = 3.8 DEGREES
REMARK 500 1 A A 3 C8 - N9 - C4 ANGL. DEV. = -2.5 DEGREES
REMARK 500 1 G A 4 N7 - C8 - N9 ANGL. DEV. = 4.8 DEGREES
REMARK 500 1 G A 4 C8 - N9 - C4 ANGL. DEV. = -3.3 DEGREES
REMARK 500 1 U A 5 O4' - C1' - N1 ANGL. DEV. = 4.6 DEGREES
REMARK 500 1 G A 6 N7 - C8 - N9 ANGL. DEV. = 4.6 DEGREES
REMARK 500 1 G A 6 C8 - N9 - C4 ANGL. DEV. = -3.0 DEGREES
REMARK 500 1 G A 7 N7 - C8 - N9 ANGL. DEV. = 4.8 DEGREES
REMARK 500 1 G A 7 C8 - N9 - C4 ANGL. DEV. = -3.0 DEGREES
REMARK 500 1 G A 9 N7 - C8 - N9 ANGL. DEV. = 4.7 DEGREES
REMARK 500 1 G A 9 C8 - N9 - C4 ANGL. DEV. = -2.7 DEGREES
REMARK 500 1 G A 12 N7 - C8 - N9 ANGL. DEV. = 4.2 DEGREES
REMARK 500 1 G A 12 C8 - N9 - C4 ANGL. DEV. = -3.3 DEGREES
REMARK 500 1 A A 13 N7 - C8 - N9 ANGL. DEV. = 3.7 DEGREES
REMARK 500 1 A A 16 N7 - C8 - N9 ANGL. DEV. = 3.9 DEGREES
REMARK 500 1 A A 16 C8 - N9 - C4 ANGL. DEV. = -2.9 DEGREES
REMARK 500 1 U A 19 O4' - C1' - N1 ANGL. DEV. = 4.7 DEGREES
REMARK 500 1 A A 20 N7 - C8 - N9 ANGL. DEV. = 3.9 DEGREES
REMARK 500 1 A A 20 C8 - N9 - C4 ANGL. DEV. = -2.9 DEGREES
REMARK 500 1 A A 21 C3' - C2' - C1' ANGL. DEV. = 5.1 DEGREES
REMARK 500 1 A A 21 O4' - C1' - N9 ANGL. DEV. = 5.6 DEGREES
REMARK 500 1 A A 21 N7 - C8 - N9 ANGL. DEV. = 4.2 DEGREES
REMARK 500 1 A A 21 C8 - N9 - C4 ANGL. DEV. = -2.8 DEGREES
REMARK 500 1 A A 22 N7 - C8 - N9 ANGL. DEV. = 4.1 DEGREES
REMARK 500 1 A A 23 N7 - C8 - N9 ANGL. DEV. = 3.1 DEGREES
REMARK 500 1 A A 23 C8 - N9 - C4 ANGL. DEV. = -2.8 DEGREES
REMARK 500 1 A A 24 N7 - C8 - N9 ANGL. DEV. = 3.0 DEGREES
REMARK 500 1 A A 24 C8 - N9 - C4 ANGL. DEV. = -2.8 DEGREES
REMARK 500 1 A A 26 N7 - C8 - N9 ANGL. DEV. = 3.8 DEGREES
REMARK 500 1 A A 27 N7 - C8 - N9 ANGL. DEV. = 3.5 DEGREES
REMARK 500 1 A A 27 C8 - N9 - C4 ANGL. DEV. = -2.7 DEGREES
REMARK 500 1 G A 29 N7 - C8 - N9 ANGL. DEV. = 4.9 DEGREES
REMARK 500 1 G A 29 C8 - N9 - C4 ANGL. DEV. = -3.1 DEGREES
REMARK 500 1 G A 30 N7 - C8 - N9 ANGL. DEV. = 4.8 DEGREES
REMARK 500 1 G A 30 C8 - N9 - C4 ANGL. DEV. = -3.2 DEGREES
REMARK 500 2 A A 3 N7 - C8 - N9 ANGL. DEV. = 3.8 DEGREES
REMARK 500 2 A A 3 C8 - N9 - C4 ANGL. DEV. = -2.5 DEGREES
REMARK 500 2 G A 4 N7 - C8 - N9 ANGL. DEV. = 4.6 DEGREES
REMARK 500 2 G A 4 C8 - N9 - C4 ANGL. DEV. = -3.0 DEGREES
REMARK 500 2 G A 6 O4' - C1' - N9 ANGL. DEV. = 5.8 DEGREES
REMARK 500 2 G A 6 N7 - C8 - N9 ANGL. DEV. = 4.3 DEGREES
REMARK 500 2 G A 6 C8 - N9 - C4 ANGL. DEV. = -3.0 DEGREES
REMARK 500 2 G A 7 O4' - C1' - N9 ANGL. DEV. = 9.9 DEGREES
REMARK 500 2 G A 7 N7 - C8 - N9 ANGL. DEV. = 3.5 DEGREES
REMARK 500 2 G A 9 N7 - C8 - N9 ANGL. DEV. = 4.6 DEGREES
REMARK 500 2 G A 9 C8 - N9 - C4 ANGL. DEV. = -2.7 DEGREES
REMARK 500 2 G A 12 N7 - C8 - N9 ANGL. DEV. = 3.9 DEGREES
REMARK 500 2 G A 12 C8 - N9 - C4 ANGL. DEV. = -3.9 DEGREES
REMARK 500 2 A A 13 N7 - C8 - N9 ANGL. DEV. = 3.7 DEGREES
REMARK 500 2 A A 16 N7 - C8 - N9 ANGL. DEV. = 3.7 DEGREES
REMARK 500
REMARK 500 THIS ENTRY HAS 794 ANGLE DEVIATIONS.
REMARK 500
REMARK 500 REMARK: NULL
REMARK 500
REMARK 500 GEOMETRY AND STEREOCHEMISTRY
REMARK 500 SUBTOPIC: PLANAR GROUPS
REMARK 500
REMARK 500 PLANAR GROUPS IN THE FOLLOWING RESIDUES HAVE A TOTAL
REMARK 500 RMS DISTANCE OF ALL ATOMS FROM THE BEST-FIT PLANE
REMARK 500 BY MORE THAN AN EXPECTED VALUE OF 6*RMSD, WITH AN
REMARK 500 RMSD 0.02 ANGSTROMS, OR AT LEAST ONE ATOM HAS
REMARK 500 AN RMSD GREATER THAN THIS VALUE
REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER;
REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE).
REMARK 500
REMARK 500 M RES CSSEQI RMS TYPE
REMARK 500 1 A A 3 0.07 SIDE CHAIN
REMARK 500 1 G A 4 0.08 SIDE CHAIN
REMARK 500 1 G A 6 0.08 SIDE CHAIN
REMARK 500 1 G A 7 0.06 SIDE CHAIN
REMARK 500 1 C A 10 0.07 SIDE CHAIN
REMARK 500 1 C A 11 0.07 SIDE CHAIN
REMARK 500 1 G A 12 0.08 SIDE CHAIN
REMARK 500 1 C A 14 0.07 SIDE CHAIN
REMARK 500 1 C A 15 0.08 SIDE CHAIN
REMARK 500 1 A A 16 0.09 SIDE CHAIN
REMARK 500 1 C A 17 0.07 SIDE CHAIN
REMARK 500 1 U A 18 0.11 SIDE CHAIN
REMARK 500 1 G A 29 0.07 SIDE CHAIN
REMARK 500 1 G A 30 0.08 SIDE CHAIN
REMARK 500 2 A A 3 0.07 SIDE CHAIN
REMARK 500 2 G A 4 0.08 SIDE CHAIN
REMARK 500 2 U A 5 0.07 SIDE CHAIN
REMARK 500 2 G A 6 0.07 SIDE CHAIN
REMARK 500 2 G A 7 0.06 SIDE CHAIN
REMARK 500 2 C A 10 0.06 SIDE CHAIN
REMARK 500 2 C A 11 0.08 SIDE CHAIN
REMARK 500 2 G A 12 0.07 SIDE CHAIN
REMARK 500 2 C A 14 0.06 SIDE CHAIN
REMARK 500 2 C A 15 0.08 SIDE CHAIN
REMARK 500 2 A A 16 0.09 SIDE CHAIN
REMARK 500 2 C A 17 0.08 SIDE CHAIN
REMARK 500 2 U A 18 0.11 SIDE CHAIN
REMARK 500 2 A A 26 0.05 SIDE CHAIN
REMARK 500 2 C A 28 0.07 SIDE CHAIN
REMARK 500 2 G A 29 0.08 SIDE CHAIN
REMARK 500 2 G A 30 0.07 SIDE CHAIN
REMARK 500 3 A A 3 0.07 SIDE CHAIN
REMARK 500 3 G A 4 0.08 SIDE CHAIN
REMARK 500 3 U A 5 0.07 SIDE CHAIN
REMARK 500 3 G A 6 0.07 SIDE CHAIN
REMARK 500 3 G A 7 0.06 SIDE CHAIN
REMARK 500 3 C A 10 0.07 SIDE CHAIN
REMARK 500 3 C A 11 0.08 SIDE CHAIN
REMARK 500 3 G A 12 0.07 SIDE CHAIN
REMARK 500 3 C A 14 0.06 SIDE CHAIN
REMARK 500 3 C A 15 0.08 SIDE CHAIN
REMARK 500 3 A A 16 0.09 SIDE CHAIN
REMARK 500 3 C A 17 0.07 SIDE CHAIN
REMARK 500 3 U A 18 0.08 SIDE CHAIN
REMARK 500 3 G A 29 0.08 SIDE CHAIN
REMARK 500 3 G A 30 0.08 SIDE CHAIN
REMARK 500 4 A A 3 0.07 SIDE CHAIN
REMARK 500 4 G A 4 0.08 SIDE CHAIN
REMARK 500 4 U A 5 0.08 SIDE CHAIN
REMARK 500 4 G A 6 0.07 SIDE CHAIN
REMARK 500
REMARK 500 THIS ENTRY HAS 311 PLANE DEVIATIONS.
REMARK 500
REMARK 500 REMARK: NULL
REMARK 900
REMARK 900 RELATED ENTRIES
REMARK 900 RELATED ID: 2AP5 RELATED DB: PDB
REMARK 900 AVERAGE STRUCTURE
DBREF 2AP0 A 3 30 PDB 2AP0 2AP0 3 30
SEQRES 1 A 28 A G U G G CH G C C G A C C
SEQRES 2 A 28 A C U U A A A A A C A A C
SEQRES 3 A 28 G G
MODRES 2AP0 CH A 8 C N3-PROTONATED CYTIDINE-5'-MONOPHOSPHATE
HET CH A 8 32
HETNAM CH N3-PROTONATED CYTIDINE-5'-MONOPHOSPHATE
FORMUL 1 CH C9 H15 N3 O8 P 1+
LINK O3' G A 7 P CH A 8 1555 1555 1.61
LINK O3' CH A 8 P G A 9 1555 1555 1.61
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