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2AYP

Crystal Structure of CHK1 with an Indol Inhibitor

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU RU200
Temperature [K]110
Detector technologyIMAGE PLATE
Collection date2001-01-01
DetectorMARRESEARCH
Wavelength(s)1.54
Spacegroup nameP 1 21 1
Unit cell lengths45.043, 65.698, 57.860
Unit cell angles90.00, 94.39, 90.00
Refinement procedure
Resolution19.680 - 2.900
Rwork0.209
R-free0.31400
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.008
RMSD bond angle1.300
Data reduction softwareHKL-2000
Data scaling softwareSCALEPACK
Phasing softwareCNX (2000)
Refinement softwareCNX (2000)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]20.0003.000
High resolution limit [Å]2.9002.900
Number of reflections6649
Completeness [%]88.097
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP7.5298PEG 8000, Isopropanol, HEPES, pH 7.5, VAPOR DIFFUSION, SITTING DROP, temperature 298.0K

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