6NNO

Xanthomonas citri Phospho-PGM in complex with glucose-1-phosphate

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]	100
Detector technology	CMOS
Collection date	2018-04-29
Detector	RDI CMOS_8M
Wavelength(s)	1.00003
Spacegroup name	P 21 21 21
Unit cell lengths	43.820, 54.570, 172.720
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	46.132 - 1.570
R-factor	0.1717
Rwork	0.170
R-free	0.20620
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5bmn
RMSD bond length	0.006
RMSD bond angle	0.859
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]	46.132	1.600
High resolution limit [Å]	1.570	1.570
Rmerge	0.144	2.356
Rmeas	0.150	2.506
Rpim	0.041	0.839
Number of reflections	58987	2988
<I/σ(I)>	14.7	0.8
Completeness [%]	100.0	100
Redundancy	13.2	8.7
CC(1/2)	0.999	0.332

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