11LJ

Human OGA IN COMPLEX WITH LIGAND 24

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06SA
Synchrotron site	SLS
Beamline	X06SA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-12-07
Detector	DECTRIS EIGER X 16M
Wavelength(s)	1
Spacegroup name	P 41 21 2
Unit cell lengths	96.838, 96.838, 257.111
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	60.436 - 2.325
R-factor	0.2255
Rwork	0.223
R-free	0.26790
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.002
RMSD bond angle	0.442
Data reduction software	XDS (20190315)
Data scaling software	STARANISO (1.0.4)
Phasing software	PHASER
Refinement software	PHENIX (1.13_2998)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	60.436	2.590
High resolution limit [Å]	2.325	2.325
Rpim	0.054	0.536
Number of reflections	37403	1870
<I/σ(I)>	10.6	1.9
Completeness [%]	93.8	69.9
Redundancy	13
CC(1/2)	0.998	0.739

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	6-20% (w/v) PEG-3350, 0.2M Calcium Acetate, 0.01M Barium Chloride