9HYJ

AlfB fucosidase in complex with Fucose

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALBA BEAMLINE XALOC
Synchrotron site	ALBA
Beamline	XALOC
Temperature [K]	100
Detector technology	PIXEL
Collection date	2014-03-12
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.97928
Spacegroup name	C 2 2 21
Unit cell lengths	167.162, 308.288, 173.859
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	49.030 - 2.250
R-factor	0.18105
Rwork	0.180
R-free	0.20903
Structure solution method	MOLECULAR REPLACEMENT
Data reduction software	XDS
Data scaling software	SCALEPACK
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0430)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	49.270	2.370
High resolution limit [Å]	2.250	2.250
Rpim	0.070	0.382
Number of reflections	211026	30623
<I/σ(I)>	7.9
Completeness [%]	100.0
Redundancy	6.4
CC(1/2)	0.992	0.655

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		294	3% PEG 8000, 25% MPD, 7% Taximate pH 5