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7M0V

Crystal structure of the BRAF:MEK1 kinases in complex with AMPPNP and Cobimetinib

Replaces:  6V2Z
Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 24-ID-C
Synchrotron siteAPS
Beamline24-ID-C
Temperature [K]100
Detector technologyPIXEL
Collection date2019-11-13
DetectorDECTRIS PILATUS 6M
Wavelength(s)0.979
Spacegroup nameP 31 2 1
Unit cell lengths116.144, 116.144, 129.886
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution43.300 - 3.160
R-factor0.188
Rwork0.186
R-free0.23360
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)6pp9
Data reduction softwareXDS
Data scaling softwareAimless
Phasing softwarePHASER
Refinement softwarePHENIX (1.19_4092)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]43.3003.273
High resolution limit [Å]3.1603.160
Rmerge0.154
Rmeas0.154
Rpim0.0360.472
Number of reflections177941747
<I/σ(I)>18.761.63
Completeness [%]99.9
Redundancy19.6
CC(1/2)1.0000.745
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP8.5293100 mM Tris 8.5, 200 mM Lithium Sulfate and 22% PEG 3,350

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