9L3P

Crystal structure of endo-processive xyloglucanase Xeg5A E285A from Aspergillus oryzae with GLLX/L

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SPRING-8 BEAMLINE BL44XU
Synchrotron site	SPring-8
Beamline	BL44XU
Temperature [K]	100
Detector technology	PIXEL
Collection date	2023-07-18
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.9
Spacegroup name	C 2 2 21
Unit cell lengths	112.596, 116.463, 105.418
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	37.790 - 2.340
R-factor	0.2064
Rwork	0.206
R-free	0.21540
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.010
RMSD bond angle	1.147
Data reduction software	XDS (Jan 10, 2022)
Data scaling software	XDS (Jan 10, 2022)
Phasing software	PHASER
Refinement software	PHENIX (1.21.1_5286)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	44.180	2.430
High resolution limit [Å]	2.340	2.340
Rmerge	0.140
Rpim	0.065
Number of reflections	29373	2839
<I/σ(I)>	9.2	1
Completeness [%]	99.6	98
Redundancy	5.4	5.4
CC(1/2)	0.997	0.523

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6.5	293	0.2 M ammonium acetate, 0.1 M bis-Tris methane, 25% PEG3350