9FK2

The structure of glycosynthase XT6 (E265G mutant), the extracellular xylanase of G.proteiniphilus T-6 in complex with two xylobiose-F molecules

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-11-01
Detector	DECTRIS PILATUS 200K
Wavelength(s)	1.54
Spacegroup name	I 1 2 1
Unit cell lengths	89.269, 61.524, 110.338
Unit cell angles	90.00, 105.50, 90.00

Refinement procedure

Resolution	36.370 - 2.250
R-factor	0.1618
Rwork	0.160
R-free	0.20450
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.007
RMSD bond angle	0.832
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHENIX
Refinement software	PHENIX (1.17.1_3660)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	36.370	2.330
High resolution limit [Å]	2.250	2.250
Rmerge	0.140	0.410
Rmeas	0.160	0.510
Rpim	0.080	0.290
Number of reflections	27548	2482
<I/σ(I)>	6.9	2.4
Completeness [%]	99.9
Redundancy	3.7
CC(1/2)	0.950	0.780

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.5	293	0.01M Zinc chloride, 17% PEG 5000, and 0.1M MES buffer at pH 6.5.