6HCL

Crystal structure of a MFS transporter with Ligand at 2.69 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	2018-06-08
Detector	DECTRIS EIGER X 16M
Wavelength(s)	1
Spacegroup name	P 21 21 2
Unit cell lengths	103.423, 200.016, 63.323
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	24.826 - 2.500
R-factor	0.24
Rwork	0.239
R-free	0.25930
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6g9x
RMSD bond length	0.007
RMSD bond angle	0.911
Data reduction software	XDS (Jan 26, 2018 (BUILT 20180302))
Data scaling software	autoPROC (1.0.5 (20170920))
Phasing software	PHASER (2.8.1)
Refinement software	PHENIX ((1.13_2998: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	47.520	2.680
High resolution limit [Å]	2.500	2.500
Rmeas	0.118	5.100
Rpim	0.020	0.900
Number of reflections	30961	1341
<I/σ(I)>	40.8	1.3
Completeness [%]	94.4	88.1
Redundancy	55.9	57.2
CC(1/2)	1.000	0.590

Crystallization Conditions

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