36JS

Tri-complex of RMC-0708, KRas Q61H, and CypA

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS-II BEAMLINE 17-ID-2
Synchrotron site	NSLS-II
Beamline	17-ID-2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2022-05-28
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.9201
Spacegroup name	P 1 2 1
Unit cell lengths	65.470, 47.750, 101.810
Unit cell angles	90.00, 93.19, 90.00

Refinement procedure

Resolution	33.880 - 1.750
R-factor	0.1902
Rwork	0.187
R-free	0.24200
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.011
RMSD bond angle	1.188
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX (1.21.1_5286)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	33.880	1.780
High resolution limit [Å]	1.750	1.750
Rmerge	0.138	1.407
Rpim	0.082	0.817
Number of reflections	63537	2778
<I/σ(I)>	4.98	0.65
Completeness [%]	99.5
Redundancy	3.8
CC(1/2)	0.992	0.273

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		291	25% PEG 3350, 0.1M Bis Tris, pH 5.5, 150 mM NaCl