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4FSM

Crystal Structure of the CHK1

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU RU200
Temperature [K]110
Detector technologyIMAGE PLATE
DetectorMARRESEARCH
Wavelength(s)1.54
Spacegroup nameP 1 21 1
Unit cell lengths45.050, 66.543, 57.831
Unit cell angles90.00, 94.73, 90.00
Refinement procedure
Resolution19.890 - 2.300
R-factor0.1764
Rwork0.175
R-free0.19830
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.010
RMSD bond angle0.990
Data scaling softwareSCALEPACK
Refinement softwareBUSTER-TNT (BUSTER 2.11.1)
Data quality characteristics
 OverallInner shellOuter shell
Low resolution limit [Å]20.00020.0002.380
High resolution limit [Å]2.3004.9302.300
Rmerge0.0620.0300.272
Number of reflections15818
<I/σ(I)>11.6
Completeness [%]99.910099.1
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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