6HPP

X-ray structure of GLIC in complex with propionate

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID23-1
Synchrotron site	ESRF
Beamline	ID23-1
Temperature [K]	200
Detector technology	PIXEL
Collection date	2014-02-20
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.97
Spacegroup name	C 1 2 1
Unit cell lengths	180.690, 133.730, 158.890
Unit cell angles	90.00, 101.38, 90.00

Refinement procedure

Resolution	20.000 - 3.200
R-factor	0.195
Rwork	0.194
R-free	0.20100
RMSD bond length	0.009
RMSD bond angle	0.970
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	REFMAC
Refinement software	BUSTER (2.10.3)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	20.000	3.280
High resolution limit [Å]	3.200	3.200
Number of reflections	61051
<I/σ(I)>	6.7
Completeness [%]	97.1
Redundancy	3.6
CC(1/2)	0.990	0.413

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	100 mM Na-propionate, pH 4 400 mM NaIsothiocyanate 12-15% PEG4000 2% DMSO 15% glycreol