6V40

Structure of Salmonella Typhi TtsA

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS-II BEAMLINE 17-ID-1
Synchrotron site	NSLS-II
Beamline	17-ID-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-06-08
Detector	DECTRIS EIGER X 9M
Wavelength(s)	0.97936
Spacegroup name	C 2 2 21
Unit cell lengths	136.985, 138.607, 135.199
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	43.370 - 2.104
R-factor	0.1928
Rwork	0.191
R-free	0.22150
Structure solution method	SAD
RMSD bond length	0.013
RMSD bond angle	1.712
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	REFMAC (5.8.0258)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	43.410	2.179
High resolution limit [Å]	2.100	2.104
Rmerge	0.068	0.964
Number of reflections	73442	6414
<I/σ(I)>	22.37	1.31
Completeness [%]	98.3
Redundancy	4.9
CC(1/2)	0.891	0.462

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	0.1 M sodium citrate pH 5.8, 0.1 m NaCl, and 18% v/v (+/-)-2-methyl-2,4-pentanediol