6ECS

Crystal structure of WHV core protein mutant Y132A dimer

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	CMOS
Collection date	2017-08-10
Detector	RDI CMOS_8M
Wavelength(s)	1.0
Spacegroup name	P 32 2 1
Unit cell lengths	116.410, 116.410, 161.760
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	63.087 - 2.900
R-factor	0.2004
Rwork	0.198
R-free	0.22790
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3kxs
RMSD bond length	0.007
RMSD bond angle	0.859
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX ((1.11.1_2575: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	63.090	3.004
High resolution limit [Å]	2.900	2.900
Rmerge	0.108	1.638
Rmeas	0.114	1.728
Rpim	0.034	0.545
Number of reflections	28665	2817
<I/σ(I)>	19.47	1.28
Completeness [%]	99.9	99.93
Redundancy	10.9	9.9
CC(1/2)	0.999	0.589

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	5.8	296.35	13% polyethylene glycol 400, 240 mM KCl and 50 mM MES (pH 5.8)