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4EK6

Crystal structure of the cdk2 in complex with aminopyrazole inhibitor

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 21-ID-G
Synchrotron siteAPS
Beamline21-ID-G
Temperature [K]100
Detector technologyCCD
Collection date2009-10-17
DetectorMARMOSAIC 300 mm CCD
Wavelength(s)0.97857
Spacegroup nameP 21 21 21
Unit cell lengths53.328, 71.647, 72.332
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution22.250 - 1.520
R-factor0.189
Rwork0.188
R-free0.21700
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.010
RMSD bond angle0.990
Data reduction softwareHKL-2000
Data scaling softwareSCALEPACK
Phasing softwarePHASER
Refinement softwareBUSTER (2.11.1)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0001.550
High resolution limit [Å]1.5201.520
Rmerge0.0440.440
Number of reflections43179
<I/σ(I)>15.1
Completeness [%]99.595.5
Redundancy6.94.2
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP7.815-20% PEG3350, 0.2M AMMONIUM ACETATE, 0.1M HEPES, pH 7.8, VAPOR DIFFUSION, SITTING DROP

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