6E57

Bacteroides ovatus mixed-linkage glucan utilization locus (MLGUL) SGBP-B in complex with mixed-linkage heptasaccharide

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 21-ID-G
Synchrotron site	APS
Beamline	21-ID-G
Temperature [K]	100
Detector technology	CCD
Collection date	2016-12-08
Detector	MARMOSAIC 300 mm CCD
Wavelength(s)	0.9786
Spacegroup name	P 21 21 21
Unit cell lengths	156.438, 243.652, 76.059
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	78.340 - 2.710
R-factor	0.1965
Rwork	0.194
R-free	0.23820
Structure solution method	SAD
RMSD bond length	0.004
RMSD bond angle	0.861
Data reduction software	HKL-2000
Data scaling software	xia2
Phasing software	AutoSol
Refinement software	REFMAC (5.8.0222)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	78.340	2.807
High resolution limit [Å]	2.710	2.710
Rmerge	0.124	0.811
Number of reflections	78048	7714
<I/σ(I)>	10.44	2.42
Completeness [%]	97.7	98.32
Redundancy	5.7
CC(1/2)		0.700

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.5	293	JCSG Plus screen in C5 (0.8 M NaH2PO4, 0.8 M KH2PO4, 0.1M sodium HEPES pH 7.5)