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1RYS

REPLICATION OF A CIS-SYN THYMINE DIMER AT ATOMIC RESOLUTION

Replaces:  1PM8
Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU RU200
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date2002-10-22
DetectorRIGAKU RAXIS IV
Spacegroup nameP 21 21 21
Unit cell lengths98.732, 102.290, 106.069
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution19.900 - 2.000

*

R-factor0.221
Rwork0.221
R-free0.25600
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.010

*

RMSD bond angle1.700
Data reduction softwareHKL-2000
Data scaling softwareSCALEPACK
Phasing softwareCNS
Refinement softwareCNS
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]19.900
High resolution limit [Å]2.0002.030

*

Rmerge0.044

*

0.492

*

Number of reflections69785
Completeness [%]99.4

*

95

*

Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP720

*

PEG3350, CA(AC)2, pH 7.00, VAPOR DIFFUSION, HANGING DROP, temperature 293K
Crystallization Reagents
IDcrystal IDsolution IDreagent nameconcentrationdetails
111PEG3350
211CA(AC)2
311H2O
412PEG3350
512CA(AC)2
612H2O
Crystallization Reagents in Literatures
IDcrystal IDsolutionreagent nameconcentration (unit)details
11reservoir15 (%)
21reservoircalcium acetate0.2 (M)
31reservoirglycerol2.5 (%)
41dropDpo46 (mg/ml)
51dropHEPES20 (mM)pH7.0
61drop5 (mM)
71drop150 (mM)

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