6ZGR

Crystal structure of a MFS transporter with bound 1-hydroxynaphthalene-2-carboxylic acid at 2.67 Angstroem resolution

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	2018-09-24
Detector	DECTRIS EIGER X 16M
Wavelength(s)	1.0
Spacegroup name	P 21 21 2
Unit cell lengths	103.553, 199.572, 62.468
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	14.983 - 2.460
R-factor	0.2226
Rwork	0.221
R-free	0.25500
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6g9x
Data reduction software	XDS
Data scaling software	Aimless (0.7.1)
Phasing software	PHASER (2.8.2)
Refinement software	PHENIX (1.14_3228)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	47.140	47.140	2.590
High resolution limit [Å]	2.460	7.780	2.460
Rmerge	0.143	0.061
Rmeas	0.145	0.062	281.735
Rpim	0.022	0.010	39.476
Total number of observations	2295711
Number of reflections	47962	1682	6896
<I/σ(I)>	22
Completeness [%]	100.0	99.6	99.9
Redundancy	47.9	35.6	49.3
CC(1/2)	0.999	0.999	0.196

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7	291.15	zinc bromide, HEPES, jeffamine ED-2003