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7R0N

KRasG12C in complex with GDP and compound 2

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSLS BEAMLINE X10SA
Synchrotron siteSLS
BeamlineX10SA
Temperature [K]100
Detector technologyPIXEL
Collection date2016-08-05
DetectorDECTRIS PILATUS 6M-F
Wavelength(s)1.0000
Spacegroup nameP 21 21 21
Unit cell lengths41.351, 59.228, 65.207
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution23.500 - 1.200
R-factor0.203
Rwork0.202
R-free0.22200
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1WXEX
RMSD bond length0.008
RMSD bond angle1.020
Data reduction softwareXDS
Data scaling softwareXSCALE
Phasing softwarePHASER
Refinement softwareBUSTER (2.11.8)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]65.2101.230
High resolution limit [Å]1.2001.200
Rmerge0.0390.696
Number of reflections507791016
<I/σ(I)>19.82.24
Completeness [%]99.999.9
Redundancy6.225.58
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP29333% PEG 6000, 0.01 M NaCitrate

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