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7M0W

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

Replaces:  6V30
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 lengths117.334, 117.334, 130.004
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution43.550 - 3.090
R-factor0.1967
Rwork0.195
R-free0.23320
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)6pp9
Data reduction softwareXDS
Data scaling softwareAimless
Phasing softwarePHASER
Refinement softwarePHENIX (1.18.2_3874)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]43.5523.200
High resolution limit [Å]3.0903.090
Rmerge0.126
Rmeas0.131
Rpim0.034
Number of reflections194011901
<I/σ(I)>18.681.59
Completeness [%]99.9
Redundancy14.1
CC(1/2)1.0000.660
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP293100 mM Tris 8.5, 200 mM Lithium Sulfate and 22% PEG 3,350

222415

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