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6Y0A

CRYSTAL STRUCTURE OF CDK8-CycC IN COMPLEX WITH BI00690300

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSLS BEAMLINE X06SA
Synchrotron siteSLS
BeamlineX06SA
Temperature [K]100
Detector technologyPIXEL
Collection date2014-08-01
DetectorPSI PILATUS 6M
Wavelength(s)0.99988
Spacegroup nameP 21 21 21
Unit cell lengths70.598, 71.120, 169.785
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution84.890 - 2.190
R-factor0.20161
Rwork0.201
R-free0.22679
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)4f6s
RMSD bond length0.008
RMSD bond angle1.242
Data reduction softwareXDS
Data scaling softwareXSCALE
Phasing softwareMOLREP
Refinement softwareREFMAC (5.8.0049)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]84.8902.440
High resolution limit [Å]2.1902.190
Rmerge0.0660.440
Number of reflections4308643086
<I/σ(I)>13.48
Completeness [%]96.196.9
Redundancy2.82.8
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION29820% (wt/vol) polyethylene glycol 3350 0.2 M sodium formate

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