6NQE

Xanthomonas citri PGM Apo-Dephospho at room temperature

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]	298
Detector technology	CMOS
Collection date	2017-12-15
Detector	RDI CMOS_8M
Wavelength(s)	1.00003
Spacegroup name	P 21 21 21
Unit cell lengths	44.360, 55.620, 174.850
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	53.003 - 1.850
R-factor	0.1621
Rwork	0.161
R-free	0.18730
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5bmn
RMSD bond length	0.006
RMSD bond angle	0.876
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.11.1_2575)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	53.003	1.890
High resolution limit [Å]	1.850	1.850
Rmerge	0.124	2.081
Rmeas	0.134	2.254
Rpim	0.051	0.852
Number of reflections	37952	2257
<I/σ(I)>	10.1	0.9
Completeness [%]	100.0	100
Redundancy	6.9	6.9
CC(1/2)	0.997	0.375

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.5	277	22% PEG 8000, 0.2M MgCl, 0.1M HEPES