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1V1K

CDK2 IN COMPLEX WITH A DISUBSTITUTED 4, 6-BIS ANILINO PYRIMIDINE CDK4 INHIBITOR

Replaces:  1H06
Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSRS BEAMLINE PX9.6
Synchrotron siteSRS
BeamlinePX9.6
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date1997-12-15
DetectorMARRESEARCH
Spacegroup nameP 21 21 21
Unit cell lengths54.342, 72.932, 73.838
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution51.990 - 2.310
R-factor0.211
Rwork0.208
R-free0.26900
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.014
RMSD bond angle1.497
Data reduction softwareMOSFLM
Data scaling softwareSCALA
Phasing softwareAMoRE
Refinement softwareREFMAC (5.1.17)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]51.9902.440
High resolution limit [Å]2.3102.310
Rmerge0.0780.233
Number of reflections11954
<I/σ(I)>13.35.3
Completeness [%]90.684.8
Redundancy2.52.5
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
17PROTEIN AT 10MG/ML WELL BUFFER CONTAINING 17.5% PEG3350, 200MM HEPES, PH7.0, 100MM AMMONIUM ACETATE, pH 7.00

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