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1PYE

Crystal structure of CDK2 with inhibitor

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 17-ID
Synchrotron siteAPS
Beamline17-ID
Temperature [K]200
Detector technologyCCD
Collection date2000-06-10
DetectorMACSCIENCE
Wavelength(s)1.0
Spacegroup nameP 21 21 21
Unit cell lengths52.803, 72.111, 71.090
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution30.000 - 2.000
R-factor0.24
Rwork0.239
R-free0.25200
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.010
RMSD bond angle1.400
Data reduction softwareHKL-2000
Data scaling softwareSCALEPACK
Phasing softwareAMoRE
Refinement softwareCNS
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]30.0002.070
High resolution limit [Å]2.0002.000
Rmerge0.0630.307
Number of reflections18821
<I/σ(I)>8.3
Completeness [%]99.497
Redundancy105
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP7.5298PEG 3000, Hepes, NaCl, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 298K

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