9MJL

SOS1 IN COMPLEX WITH AN INHIBITOR

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL18U1
Synchrotron site	SSRF
Beamline	BL18U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-12-31
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.97915
Spacegroup name	P 21 21 21
Unit cell lengths	38.330, 83.620, 168.240
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	46.580 - 2.620
Rwork	0.259
R-free	0.32100
Structure solution method	MOLECULAR REPLACEMENT
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PRIME-X

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	46.580	2.740
High resolution limit [Å]	2.620	2.620
Rmerge	0.109	1.013
Rmeas	0.116	1.068
Rpim	0.037	0.334
Number of reflections	17076	2060
<I/σ(I)>	14.9	2.3
Completeness [%]	100.0	100
Redundancy	9.5
CC(1/2)	0.998	0.795

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		291	0.1 M imidazole, 8-18% PEG 8000