7O0N

Crystal structure of a ParB E93A mutant from Myxococcus xanthus bound to CDP and monothiophosphate

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID30B
Synchrotron site	ESRF
Beamline	ID30B
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-02-12
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.97625
Spacegroup name	P 21 21 21
Unit cell lengths	44.120, 80.370, 136.830
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	41.990 - 1.890
R-factor	0.197
Rwork	0.196
R-free	0.21600
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	7bnk
RMSD bond length	0.008
RMSD bond angle	1.319
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	REFMAC (5.8.0267)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	41.990	1.950
High resolution limit [Å]	1.890	1.890
Rmerge	0.093	1.938
Number of reflections	39707	3794
<I/σ(I)>	14.18	1.09
Completeness [%]	99.7
Redundancy	12.3
CC(1/2)		0.578

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION		294	0.1 M Phosphate-citrate pH 4.2; 40% (v/v) PEG 300