6NNT

Xanthomonas citri Dephospho-PGM in complex with glucose-1,6-bisphosphate

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	2017-12-15
Detector	RDI CMOS_8M
Wavelength(s)	1.00003
Spacegroup name	P 21 21 21
Unit cell lengths	43.620, 54.740, 173.290
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	52.198 - 1.450
R-factor	0.1709
Rwork	0.169
R-free	0.20780
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5bmn
RMSD bond length	0.006
RMSD bond angle	0.908
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]	52.200	1.470
High resolution limit [Å]	1.450	1.450
Rmerge	0.114	2.421
Rmeas	0.118	2.559
Rpim	0.030	0.807
Number of reflections	74685	3597
<I/σ(I)>	17.1	0.9
Completeness [%]	100.0	99.3
Redundancy	14.9	9.8
CC(1/2)	0.999	0.429

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.5	292	22% PEG 8000, 0.2M MgCl, 0.1M HEPES