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5CVG

Crystal Structure of CK2alpha with a novel closed conformation of the aD loop

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsDIAMOND BEAMLINE I04
Synchrotron siteDiamond
BeamlineI04
Temperature [K]100
Detector technologyPIXEL
Collection date2013-09-14
DetectorDECTRIS PILATUS 6M
Wavelength(s)0.9795
Spacegroup nameP 1 21 1
Unit cell lengths57.587, 44.086, 62.039
Unit cell angles90.00, 110.38, 90.00
Refinement procedure
Resolution35.130 - 1.250
R-factor0.154
Rwork0.153
R-free0.16980
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)5cvh
RMSD bond length0.011
RMSD bond angle1.040
Data reduction softwareXDS
Data scaling softwareAimless (0.5.4)
Phasing softwarePHASER
Refinement softwareBUSTER-TNT
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]35.1301.254
High resolution limit [Å]1.2501.250
Rmerge0.0420.446
Rpim0.0270.271
Total number of observations23192922648
Number of reflections73445
<I/σ(I)>14.82.1
Completeness [%]90.848.3
Redundancy3.22.4
CC(1/2)0.9980.829
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP6.529892mM Mes pH 6.5, 33% glycerol ethoxylate, 750mM ammonium acetate

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