5OK0

Structure of the D10N mutant of beta-phosphoglucomutase from Lactococcus lactis trapped with native reaction intermediate beta-glucose 1,6-bisphosphate to 2.2A resolution.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I04
Synchrotron site	Diamond
Beamline	I04
Temperature [K]	100
Detector technology	PIXEL
Collection date	2016-07-10
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.97950
Spacegroup name	P 21 21 21
Unit cell lengths	36.810, 54.940, 103.340
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.510 - 2.150
R-factor	0.2235
Rwork	0.220
R-free	0.29234
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2wf5
RMSD bond length	0.012
RMSD bond angle	1.495
Data reduction software	XDS
Data scaling software	xia2
Refinement software	REFMAC (5.8.0131)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.510	2.190
High resolution limit [Å]	2.150	2.150
Rmerge	0.339	1.683
Rpim	0.148	0.721
Number of reflections	11990	598
<I/σ(I)>	5.3	1.2
Completeness [%]	100.0	100
Redundancy	6.2	6.4
CC(1/2)	0.980	0.391

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.2	291	24-34% PEG 4000 200mM Tris pH 7.5 200mM sodium acetate harvested after 1 week