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317D

STRUCTURE OF D(CCTAGGG): COMPARISON WITH NINE ISOMORPHOUS OCTAMER SEQUENCES REVEALS FOUR DISTINCT PATTERNS OF SEQUENCE-DEPENDENT INTERMOLECULAR INTERACTIONS

Experimental procedure
Source typeROTATING ANODE
Temperature [K]295
Detector technologyAREA DETECTOR
Collection date1994-03-01
DetectorSIEMENS-NICOLET
Spacegroup nameP 43 21 2
Unit cell lengths42.220, 42.220, 24.900
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution8.000 - 1.900
R-factor0.164
Rwork0.164
Starting model (for MR)ADH012
RMSD bond length0.013
RMSD bond angle3.510
Data reduction softwareXENGEN (V. 2.0)
Refinement softwareX-PLOR
Data quality characteristics
 Overall
High resolution limit [Å]1.900
Rmerge0.029
Number of reflections1894
Completeness [%]99.9
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION7295pH 7.00, VAPOR DIFFUSION, temperature 295.00K
Crystallization Reagents
IDcrystal IDsolution IDreagent nameconcentrationdetails
111WATER
211NA CACODYLATE
311MGCL2
411SPERMINE_HCL
512WATER
612MPD
Crystallization Reagents in Literatures
IDcrystal IDsolutionreagent nameconcentration (unit)details
11dropsodium cacodylate50 (mM)
21drop20 (mM)
31dropDNA2 (mM)single strand concentration
41dropspermine tetrachloride1 (mM)
51reservoirMPD40 (%(v/v))

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