6K93

Crystal structure of the type III effector XopAI from Xanthomonas axonopodis pv. citri in space group P41212

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSRRC BEAMLINE TPS 05A
Synchrotron site	NSRRC
Beamline	TPS 05A
Temperature [K]	110
Detector technology	CCD
Collection date	2016-11-04
Detector	RAYONIX MX300-HS
Wavelength(s)	0.9198
Spacegroup name	P 41 21 2
Unit cell lengths	52.980, 52.980, 212.090
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	36.891 - 1.530
R-factor	0.1614
Rwork	0.161
R-free	0.17070
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4eln
Data reduction software	MOSFLM (v7.2.2)
Data scaling software	pointless (v1.11.21)
Phasing software	PHASER (v2.8.0)
Refinement software	PHENIX ((1.13_2998: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	37.480	1.560
High resolution limit [Å]	1.530	1.530
Rmerge	0.131	1.064
Rmeas	0.138
Rpim	0.041	0.464
Number of reflections	47011	2290
<I/σ(I)>	9.6
Completeness [%]	100.0	100
Redundancy	10.9	6.4
CC(1/2)	0.997	0.647

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8	298	16.5% 7(V/V) PEG400, 6.5%(W/V) PEG 20000, 50mM KH2PO4, pH 8.0, 1 uL of 10 mM beta-mercaptoethanol