9L3O

Crystal structure of endo-processive xyloglucanase Xeg5A from Aspergillus oryzae with XXLG

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	P 1 21 1
Unit cell lengths	79.706, 105.896, 82.946
Unit cell angles	90.00, 91.60, 90.00

Refinement procedure

Resolution	39.840 - 2.000
R-factor	0.2059
Rwork	0.204
R-free	0.24790
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.005
RMSD bond angle	0.853
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]	44.640	2.070
High resolution limit [Å]	2.000	2.000
Rmerge	0.111
Rmeas	0.132
Rpim	0.071
Number of reflections	92363	9104
<I/σ(I)>	8.6	1.1
Completeness [%]	98.9	97.5
Redundancy	3.5	3.6
CC(1/2)	0.996	0.559

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	0.2 M sodium acetate, 20% (w/v) PEG3350