6LEO

Crystal structure of thiosulfate transporter YeeE from Spirochaeta thermophila

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SPRING-8 BEAMLINE BL32XU
Synchrotron site	SPring-8
Beamline	BL32XU
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-05-15
Detector	DECTRIS EIGER X 9M
Wavelength(s)	1.44
Spacegroup name	C 2 2 21
Unit cell lengths	73.510, 95.320, 101.410
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	43.134 - 2.520
R-factor	0.2069
Rwork	0.202
R-free	0.25230
Structure solution method	SIRAS
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	AutoSol
Refinement software	PHENIX (1.16)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	43.134	43.134	2.670
High resolution limit [Å]	2.520	7.560	2.520
Rmerge	0.631	0.097	6.752
Rmeas	0.635	0.097	6.792
Total number of observations	2039899
Number of reflections	12366	866	3712
<I/σ(I)>	14.76	63.15	1.89
Completeness [%]	99.9	99.3	100
Redundancy	87.621	99.119	85.562
CC(1/2)	0.984	0.999	0.379

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	LIPIDIC CUBIC PHASE	7	293	Pentaerythritol-propoxylate, MES, NaCl