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6I2B

Crystal Structure of the Protein-Kinase A catalytic subunit from Cricetulus Griseus in complex with compounds RKp153 and RKp117

Replaces:  6EMC
Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsBESSY BEAMLINE 14.1
Synchrotron siteBESSY
Beamline14.1
Temperature [K]100
Detector technologyPIXEL
Collection date2016-12-10
DetectorDECTRIS PILATUS 6M
Wavelength(s)0.9184
Spacegroup nameP 41
Unit cell lengths83.726, 83.726, 60.267
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution48.913 - 1.970
R-factor0.2123
Rwork0.210
R-free0.24770
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.007
RMSD bond angle0.784
Data reduction softwareXDS
Data scaling softwareXDS
Phasing softwarePHASER
Refinement softwarePHENIX ((1.10.1_2155: ???))
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]48.9132.090
High resolution limit [Å]1.9701.970
Number of reflections296204728
<I/σ(I)>22.783.09
Completeness [%]99.498.5
Redundancy4.834.92
CC(1/2)0.9990.842
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP6.9277.15100 mM Mes-Bis-Tris, 75 mM lithium chloride, 1 mM DTT, 0.1 mM sodium EDTA, 0.25 mM Mega 8, 0.7 mM peptidic ligand, 5 mM RKp117, 15% v/v methanol/water in reservoir

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