9ZO9

KRAS G13D Mutant in Complex with GDP and Compound 6.

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRL BEAMLINE BL9-2
Synchrotron site	SSRL
Beamline	BL9-2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2022-01-30
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.97946
Spacegroup name	C 2 2 21
Unit cell lengths	51.660, 75.447, 82.902
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	37.910 - 1.700
R-factor	0.1637
Rwork	0.162
R-free	0.19690
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.011
RMSD bond angle	1.236
Data reduction software	HKL-2000
Data scaling software	SCALEPACK
Phasing software	PHASER
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	1.730
High resolution limit [Å]	1.700	1.700
Rmeas	0.106	0.335
Rpim	0.043	0.162
Number of reflections	17670	658
<I/σ(I)>	18
Completeness [%]	97.4
Redundancy	5.6
CC(1/2)	0.997	0.792

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	294	30% w/v PEG1K, 0.2M KH2PO4