8QW7

Crystal Structure of compound 4 in complex with KRAS G12V C118S GDP and pVHL:ElonginC:ElonginB

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X10SA
Synchrotron site	SLS
Beamline	X10SA
Temperature [K]	80
Detector technology	PIXEL
Collection date	2020-02-07
Detector	DECTRIS EIGER2 X 16M
Wavelength(s)	0.999891
Spacegroup name	P 1 21 1
Unit cell lengths	72.520, 125.929, 81.056
Unit cell angles	90.00, 111.61, 90.00

Refinement procedure

Resolution	67.420 - 2.360
R-factor	0.2476
Rwork	0.246
R-free	0.27260
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.016
RMSD bond angle	1.821
Data reduction software	autoPROC
Data scaling software	autoPROC
Phasing software	PHASER
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	67.420	2.698
High resolution limit [Å]	2.360	2.412
Rpim	0.032	0.453
Number of reflections	30823	1204
<I/σ(I)>	0.132
Completeness [%]	92.8
Redundancy	7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8.5	277	200 mM Lithium sulfate monohydrate, 100 mM BIS-TRIS propane pH 5.5, 25% w/v polyethylene glycol 3350