6K0U

Catalytic domain of GH87 alpha-1,3-glucanase D1068A in complex with tetrasaccharides

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SPRING-8 BEAMLINE BL38B1
Synchrotron site	SPring-8
Beamline	BL38B1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-10-31
Detector	DECTRIS PILATUS3 S 6M
Wavelength(s)	1.0
Spacegroup name	P 43 21 2
Unit cell lengths	132.966, 132.966, 76.498
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	42.048 - 1.950
R-factor	0.1814
Rwork	0.180
R-free	0.20560
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6k0m
Data reduction software	XDS
Data scaling software	Aimless
Refinement software	PHENIX (1.15.2_3472)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	42.048	2.070
High resolution limit [Å]	1.950	1.950
Rmerge	0.143	1.277
Number of reflections	49682	15277
<I/σ(I)>	8.9
Completeness [%]	99.0
Redundancy	4.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	1.5 M (NH4)2SO4 and 25% (v/v) glycerol