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2C6T

Crystal structure of the human CDK2 complexed with the triazolopyrimidine inhibitor

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsESRF BEAMLINE ID14-4
Synchrotron siteESRF
BeamlineID14-4
Temperature [K]100
Detector technologyCCD
Collection date2003-06-19
DetectorADSC CCD
Spacegroup nameP 21 21 2
Unit cell lengths160.418, 161.345, 66.221
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution15.000 - 2.610
R-factor0.202
Rwork0.200
R-free0.25700
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1gy3
RMSD bond length0.014
RMSD bond angle1.445
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareMOLREP
Refinement softwareREFMAC (5.1.24)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]20.0002.690
High resolution limit [Å]2.6002.600
Rmerge0.1800.520
Number of reflections50329
<I/σ(I)>51.99
Completeness [%]95.097
Redundancy2.82.7
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION7277VAPOUR DIFFUSION AT 4 DEG C, 0.1 M HEPES PH 7.0, 1M LITHIUM SULPHATE

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