6HJ3

Xray structure of GLIC in complex with fumarate

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SOLEIL BEAMLINE PROXIMA 1
Synchrotron site	SOLEIL
Beamline	PROXIMA 1
Temperature [K]	200
Detector technology	PIXEL
Collection date	2014-08-23
Detector	DECTRIS PILATUS3 S 6M
Wavelength(s)	0.97
Spacegroup name	C 1 2 1
Unit cell lengths	181.510, 132.650, 159.860
Unit cell angles	90.00, 102.08, 90.00

Refinement procedure

Resolution	20.000 - 2.700
R-factor	0.198
Rwork	0.197
R-free	0.21620
RMSD bond length	0.011
RMSD bond angle	1.160
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	REFMAC
Refinement software	BUSTER (2.10.2)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	20.000	2.900
High resolution limit [Å]	2.700	2.700
Number of reflections	100756
<I/σ(I)>	10.5
Completeness [%]	98.5
Redundancy	5.1

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION		293	30 mM Na fumarate pH 4 12-15% PEG4000 400 mM Na Isothiocyanate 15% glycerol 2% DMSO