6RRJ

GOLGI ALPHA-MANNOSIDASE II in complex with 5-(Adamantan-1yl-methoxy)-pentyl 2,5-dideoxy-2,5-imino-D-talo-hexonamide

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I03
Synchrotron site	Diamond
Beamline	I03
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-11-24
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.976
Spacegroup name	P 21 21 21
Unit cell lengths	89.354, 91.517, 132.748
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	75.460 - 1.950
R-factor	0.2027
Rwork	0.200
R-free	0.25350
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3bub
RMSD bond length	0.008
RMSD bond angle	1.524
Data reduction software	xia2
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	REFMAC (5.8.0238)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	91.520	1.990
High resolution limit [Å]	1.950	1.950
Number of reflections	80011	34362
<I/σ(I)>	9.5	1.2
Completeness [%]	100.0
Redundancy	7.9
CC(1/2)	0.997	0.812

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7	293	0.1 M Sodium Succinate, pH 7.0 10 % PEG 3350 with microseeding