8TBL

Tricomplex of RMC-7977, KRAS G12D, and CypA

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 5.0.1
Synchrotron site	ALS
Beamline	5.0.1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2023-03-01
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.97741
Spacegroup name	P 21 21 21
Unit cell lengths	65.950, 83.790, 127.060
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	63.530 - 1.880
R-factor	0.1741
Rwork	0.171
R-free	0.22710
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.006
RMSD bond angle	0.829
Data reduction software	HKL-2000
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.17.1_3660)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	63.530	1.947
High resolution limit [Å]	1.880	1.880
Rmerge	0.174	1.867
Rmeas	0.189	2.036
Rpim	0.072	0.802
Number of reflections	57210	5573
<I/σ(I)>	8.95	0.98
Completeness [%]	98.6	97.51
Redundancy	6.7	6.4
CC(1/2)	0.996	0.321

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8	291	25% PEG4000, 0.1 M Tris-HCl, pH 8.0