6RRY

GOLGI ALPHA-MANNOSIDASE II in complex with (2S,3R)-2-(Hydroxymethyl)-1,2,3,6-tetrahydro-3-pyridinol

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I04
Synchrotron site	Diamond
Beamline	I04
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-03-02
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.950
Spacegroup name	P 21 21 21
Unit cell lengths	89.473, 90.366, 132.772
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	74.310 - 1.860
R-factor	0.1881
Rwork	0.186
R-free	0.23280
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3bub
RMSD bond length	0.009
RMSD bond angle	1.543
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]	90.370	1.890
High resolution limit [Å]	1.860	1.860
Number of reflections	91011	4451
<I/σ(I)>	12.4	1.3
Completeness [%]	100.0	100
Redundancy	8.1
CC(1/2)	0.996	0.705

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	0.1 M sodium succinate, pH 7.4 10 % PEG 3350 with microseeding