6GOE

KRAS full length G12V GPPNHP

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I04-1
Synchrotron site	Diamond
Beamline	I04-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2015-09-16
Detector	DECTRIS PILATUS3 2M
Wavelength(s)	0.928
Spacegroup name	H 3
Unit cell lengths	79.880, 79.880, 78.790
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	39.940 - 1.600
R-factor	0.18373
Rwork	0.182
R-free	0.22007
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4dst
RMSD bond length	0.022
RMSD bond angle	2.071
Data reduction software	xia2
Data scaling software	xia2
Phasing software	PHASER
Refinement software	REFMAC (5.8.0158)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	39.940	1.640
High resolution limit [Å]	1.600	1.600
Rmerge	0.088	1.070
Rmeas	0.098
Rpim	0.043	0.526
Number of reflections	24651	1820
<I/σ(I)>	9.4
Completeness [%]	99.7	99.8
Redundancy	5.1	5.1
CC(1/2)	0.996	0.528

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8	277	0.1 M TrisCl, 0.2 M NaOAc and 30-35 % PEG 4000