6TYQ

Salmonella Typhi PltB Homopentamer with Neu-5NAc-9OAc-alpha-2-6-Gal-beta-1-4-GlcNAc Glycans

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 24-ID-C
Synchrotron site	APS
Beamline	24-ID-C
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-07-24
Detector	DECTRIS PILATUS 6M-F
Wavelength(s)	0.68 - 2.0
Spacegroup name	P 21 21 21
Unit cell lengths	69.752, 98.923, 99.630
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	99.630 - 1.880
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4rhr
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHENIX
Refinement software	PHENIX ((1.16_3549: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	99.630	1.930
High resolution limit [Å]	1.880	1.880
Rmerge	0.127	0.674
Number of reflections	55467	3250
<I/σ(I)>	9.8
Completeness [%]	98.5	81.4
Redundancy	6.1	2.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	4.4	298	26% PEG1500, 0.1M Sodium Acetate pH 4.4