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8S8C

Structure of Kras in complex with inhibitor MK-1084

This is a non-PDB format compatible entry.
Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU FR-X
Temperature [K]100
Detector technologyPIXEL
Collection date2020-02-20
DetectorDECTRIS PILATUS 300K
Wavelength(s)1.54178
Spacegroup nameH 3 2
Unit cell lengths93.853, 93.853, 121.021
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution48.540 - 1.900
R-factor0.18112
Rwork0.179
R-free0.22523
Structure solution methodFOURIER SYNTHESIS
RMSD bond length0.011
RMSD bond angle1.520
Data reduction softwareXDS
Data scaling softwareAimless
Phasing softwareREFMAC
Refinement softwareREFMAC (5.8.0232)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]67.4701.985
High resolution limit [Å]1.8961.896
Rmeas0.1801.600
Number of reflections15176691
<I/σ(I)>11.91.4
Completeness [%]96.372.7
Redundancy9.4
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP929330% PEG 3350 0.1M pH=9 NaH2PO4/Na2HPO4

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