9U5T

GDP-bound KRAS G12D in complex with MCB-294

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU
Temperature [K]	100
Detector technology	PIXEL
Collection date	2025-02-13
Detector	RIGAKU HyPix-Arc 150
Wavelength(s)	1.54184
Spacegroup name	H 3 2
Unit cell lengths	95.037, 95.037, 121.012
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	17.020 - 1.800
R-factor	0.17619
Rwork	0.174
R-free	0.21051
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.014
RMSD bond angle	1.995
Data reduction software	SAINT
Data scaling software	SAINT
Phasing software	PHASER (2.8.2)
Refinement software	REFMAC (5.8.0238)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	68.060	1.870
High resolution limit [Å]	1.800	1.800
Number of reflections	19663	10
<I/σ(I)>	56.7
Completeness [%]	99.8
Redundancy	14.7
CC(1/2)	1.000	0.989

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8.5	298	0.1 M Tris, pH 8.5, 26% (w/v) PEG 3350, 0.2 M sodium acetate