6K0Q

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

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	132.262, 132.262, 76.018
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	32.954 - 1.564
R-factor	0.1599
Rwork	0.159
R-free	0.17920
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]	33.000	1.660
High resolution limit [Å]	1.560	1.560
Rmerge		1.257
Number of reflections	95050	24297
<I/σ(I)>	10.8
Completeness [%]	99.8
Redundancy	4.5

Crystallization Conditions

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