7KV3

Surface glycan-binding protein A from Bacteroides thetaiotaomicron in complex with laminarihexaose

This is a non-PDB format compatible entry.

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	2020-11-18
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.97946
Spacegroup name	I 1 2 1
Unit cell lengths	76.024, 72.937, 101.484
Unit cell angles	90.00, 105.64, 90.00

Refinement procedure

Resolution	39.447 - 2.050
Rwork	0.157
R-free	0.20410
Structure solution method	SAD
RMSD bond length	0.009
RMSD bond angle	1.516
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]	39.450	2.110
High resolution limit [Å]	2.050	2.050
Number of reflections	33221	1639
<I/σ(I)>	8
Completeness [%]	99.0
Redundancy	7
CC(1/2)	0.992	0.668

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION		295	0.1 M bis-tris pH 6.5, 0.2 M lithium sulfate, 25 % (w/v) PEG3350