7ESZ

Crystal structure of the complex formed by Wolbachia cytoplasmic incompatibility factors CinA and CinB with Mn2+ from wPip

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	2018-03-27
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.97876
Spacegroup name	P 1
Unit cell lengths	85.466, 86.380, 93.018
Unit cell angles	110.06, 91.86, 115.38

Refinement procedure

Resolution	41.071 - 2.476
R-factor	0.2006
Rwork	0.198
R-free	0.25020
Structure solution method	SAD
Data scaling software	HKL-2000
Phasing software	AutoSol
Refinement software	PHENIX (1.14_3260)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.540
High resolution limit [Å]	2.476	6.780	2.500
Rmerge	0.183	0.079
Rmeas	0.211	0.096
Rpim	0.144	0.055
Number of reflections	73644	3559	3698
<I/σ(I)>	11.9
Completeness [%]	97.1	93.4	96.6
Redundancy	3	3	2.8
CC(1/2)		0.983	0.106

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	BATCH MODE		289.15	buffer A (0.2M L-Proline, 0.1M Hepes pH 7.5, 24% w/v polyethylene glycol 1500): buffer B (0.1M citric acid pH 3.5, 34% v/v polyethylene glycol 200) = 4:1