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290D

CRYSTAL STRUCTURES OF OLIGODEOXYRIBONUCLEOTIDES CONTAINING 6'-ALPHA-METHYL AND 6'-ALPHA-HYDROXY CARBOCYCLIC THYMIDINES

Experimental procedure
Source typeROTATING ANODE
Source detailsENRAF-NONIUS
Detector technologyIMAGE PLATE
Collection date1996-04-24
DetectorMARRESEARCH
Spacegroup nameP 21 21 21
Unit cell lengths25.196, 40.798, 66.265
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution10.000 - 2.500
R-factor0.17
Rwork0.170
R-free0.29200
Starting model (for MR)BDL001
RMSD bond length0.018
RMSD bond angle3.700
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Refinement softwareX-PLOR
Data quality characteristics
 Overall
High resolution limit [Å]2.500

*

Rmerge0.035
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP6.9pH 6.90, VAPOR DIFFUSION, SITTING DROP
Crystallization Reagents
IDcrystal IDsolution IDreagent nameconcentrationdetails
111WATER
211NA CACODYLATE
311MG ACETATE
411SPERMINE_HCL
512WATER
612MPD
Crystallization Reagents in Literatures
IDcrystal IDsolutionreagent nameconcentration (unit)details
11dropDNA1.0 (mM)
21dropsodium cacodylate20 (mM)
31drop18.8 (mM)
41dropspermine tetrachloride0.7 (mM)
51reservoirMPD40 (%)

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