9H6F

Bacteroides ovatus GH98 endoxylanase in complex with arabino-xylooligosaccharide

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	2022-01-21
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.93932
Spacegroup name	C 1 2 1
Unit cell lengths	186.050, 63.850, 180.490
Unit cell angles	90.00, 118.69, 90.00

Refinement procedure

Resolution	59.176 - 2.200
Rwork	0.192
R-free	0.24540
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.007
RMSD bond angle	1.635
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	REFMAC (5.8.0430 (refmacat 0.4.88))

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	59.180	59.180	2.240
High resolution limit [Å]	2.200	12.050	2.200
Number of reflections	94781	632	4621
<I/σ(I)>	9.3	28	1.4
Completeness [%]	99.9	98.3	100
Redundancy	1.9	1.8	2
CC(1/2)	0.995	0.999	0.643

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION		293	Vapour diffusion