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4FTC

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 lengths45.324, 65.896, 58.120
Unit cell angles90.00, 94.54, 90.00
Refinement procedure
Resolution30.450 - 2.000
R-factor0.1703
Rwork0.169
R-free0.19370
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.010
RMSD bond angle0.920
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Refinement softwareBUSTER-TNT (BUSTER 2.11.1)
Data quality characteristics
 OverallInner shellOuter shell
Low resolution limit [Å]50.00050.0002.070
High resolution limit [Å]2.0004.3102.000
Rmerge0.0360.0230.208
Number of reflections22648
<I/σ(I)>20.3
Completeness [%]98.396.792.3
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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