9N9A

Crystal structure of Class-3 OPX WzaB from Myxococcus xanthus

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	CLSI BEAMLINE 08B1-1
Synchrotron site	CLSI
Beamline	08B1-1
Temperature [K]	78
Detector technology	PIXEL
Collection date	2022-09-27
Detector	DECTRIS PILATUS3 S 6M
Wavelength(s)	0.95375
Spacegroup name	H 3 2
Unit cell lengths	76.610, 76.610, 191.150
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	38.780 - 1.900
R-factor	0.212
Rwork	0.210
R-free	0.25260
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.012
RMSD bond angle	1.197
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX ((1.19.1_4122: ???))

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	38.780	38.780	1.970
High resolution limit [Å]	1.900	4.090	1.900
Rmerge	0.238
Rmeas	0.251
Rpim	0.081
Number of reflections	17408	1852	1712
<I/σ(I)>	5.6
Completeness [%]	99.7
Redundancy	10.1
CC(1/2)		0.970	0.900

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8	295	160 mM MgCl2, 80 mM Tris-HCl pH 8.0, 16% polyethylene glycol 4000, and 21% glycerol, with a 1:2 ratio of protein to reservoir solutions