6D0N

Crystal structure of a CLC-type fluoride/proton antiporter, V319G mutant

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 5.0.2
Synchrotron site	ALS
Beamline	5.0.2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-10-29
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	1
Spacegroup name	P 21 21 21
Unit cell lengths	118.106, 124.843, 135.482
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	49.670 - 3.120
R-factor	0.2494
Rwork	0.248
R-free	0.27010
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6d0j
RMSD bond length	0.002
RMSD bond angle	0.452
Data reduction software	DIALS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.13_2998)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	49.670	3.260
High resolution limit [Å]	3.120	3.120
Rmerge	0.082	2.810
Number of reflections	36328	4328
<I/σ(I)>	12.2	1.3
Completeness [%]	99.9	99.6
Redundancy	17.6	17.3
CC(1/2)	1.000	0.699

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6.2	295	10 mM HEPES, pH 7.0 100 mM ADA, pH 6.2 100 mM NaF 100 mM K Formate 24% PEG 600