1KE5

CDK2 complexed with N-methyl-4-{[(2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]amino}benzenesulfonamide

Refinement Statistics

Experimental method:X-RAY DIFFRACTION (2.2 Å)

Cell axes72.39073.96054.060
Cell angles90.0090.0090.00
SpacegroupP 21 21 21
Resolution limits8.00 - 2.20
the highest resolution shell value2.340 - 2.200
R-factor0.184*
R-work0.18400
the highest resolution shell value0.192
R-free0.22400
the highest resolution shell value0.236
RMSD bond length0.019 (0.009*)
RMSD bond angle2.100 (1.400*)

Data Collection Statistics

Resolution limits20.00 (500.00*) - 2.20
the highest resolution shell value -
Number of reflections13376
Number of measurements51192*
Rmerge_l_obs0.043
the highest resolution shell value0.082
Completeness87.6
Redundancy3.8
I/sigma(I)2

Crystallization Conditions

crystal IDmethodpHpH rangetemperatureunit
1VAPOR DIFFUSION, HANGING DROP7.5295 (20*)*

Crystallization Reagents

IDcrystal IDsolution IDreagent nameconcentrationdetails
Crystallization Reagents in Literatures*
IDcrystal IDsolutionreagent nameconcentration (unit)details
11dropprotein10 (mg/ml)
21dropHEPES20 (mM)
31dropEDTA1 (mM)
41reservoirPEG334010 (%)
Annotated Information is extracted from Literature Info*
Shewchuk L., (2000) J. Med. Chem., 43, 133.