5UFQ

K-RasG12D(GNP)/R11.1.6 complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU MICROMAX-007 HF
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2016-01-29
Detector	RIGAKU RAXIS IV++
Wavelength(s)	1.54
Spacegroup name	C 1 2 1
Unit cell lengths	119.717, 42.707, 100.235
Unit cell angles	90.00, 113.33, 90.00

Refinement procedure

Resolution	45.174 - 2.199
R-factor	0.2056
Rwork	0.200
R-free	0.26340
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	PDB ID 3GFT and PDB ID 1SSO
RMSD bond length	0.009
RMSD bond angle	1.152
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	PHENIX (1.8.4_1496)
Refinement software	PHENIX (1.8.4_1496)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	45.174	2.278
High resolution limit [Å]	2.199	2.199
Rmerge	0.102	0.352
Number of reflections	23511
<I/σ(I)>	21.83	4.5
Completeness [%]	97.7	93.48
Redundancy	7.3	6.5
CC(1/2)	0.997	0.972

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		291	calcium chloride, cadmium chloride, cobalt(II) chloride hexahydrate, PEG 3350