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7ZPC

CDK2 in complex 9K-DOS

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsDIAMOND BEAMLINE I04-1
Synchrotron siteDiamond
BeamlineI04-1
Temperature [K]100
Detector technologyPIXEL
Collection date2021-07-22
DetectorDECTRIS PILATUS 6M
Wavelength(s)0.898
Spacegroup nameP 21 21 21
Unit cell lengths53.211, 71.980, 72.068
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution50.981 - 1.400
Rwork0.201
R-free0.22110
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)5mhq
RMSD bond length0.012
RMSD bond angle1.815
Data reduction softwarexia2
Data scaling softwareAimless
Phasing softwarePHASER
Refinement softwareREFMAC (5.8.0340)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.9811.420
High resolution limit [Å]1.4001.400
Rmerge0.0220.470
Number of reflections552422663
<I/σ(I)>28.2
Completeness [%]100.0100
Redundancy11.812.5
CC(1/2)1.0001.000
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP7.529310MG/ML CDK2 10% V/V PEG3350, 50 MM HEPES/NAOH, 50 MM NA/K PHOSPHATE, PH 7.5

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