7KWB

Surface glycan-binding protein B from Bacteroides thetaiotaomicron

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRL BEAMLINE BL12-2
Synchrotron site	SSRL
Beamline	BL12-2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-11-30
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.9795
Spacegroup name	C 2 2 21
Unit cell lengths	174.101, 182.141, 92.295
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	39.400 - 2.600
R-factor	0.2407
Rwork	0.238
R-free	0.28650
Structure solution method	SAD
RMSD bond length	0.003
RMSD bond angle	1.266
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	REFMAC (5.8.0258)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	39.400	2.690
High resolution limit [Å]	2.600	2.600
Number of reflections	45378	4409
<I/σ(I)>	17
Completeness [%]	99.9
Redundancy	13.5
CC(1/2)	0.999	0.815

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION		295	0.1M HEPES pH7.4, 1.3M lithium sulfate