9PU1

HRAS complex with UM0140401 compound

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 4.2.2
Synchrotron site	ALS
Beamline	4.2.2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-02-23
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.97918
Spacegroup name	C 1 2 1
Unit cell lengths	68.307, 37.478, 63.004
Unit cell angles	90.00, 103.62, 90.00

Refinement procedure

Resolution	61.230 - 1.400
R-factor	0.16
Rwork	0.159
R-free	0.17680
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.015
RMSD bond angle	1.592
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	61.230	1.450
High resolution limit [Å]	1.400	1.400
Rmerge	0.038	0.102
Rmeas	0.044	0.121
Number of reflections	30331	2948
<I/σ(I)>	23.01	9.85
Completeness [%]	98.6	97.55
Redundancy	3.8	3.5
CC(1/2)	0.998	0.987

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293.15	Tris