8HCY

Legionella glycosyltransferase

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17B1
Synchrotron site	SSRF
Beamline	BL17B1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-07-14
Detector	DECTRIS PILATUS 200K
Wavelength(s)	0.9792
Spacegroup name	P 1 21 1
Unit cell lengths	92.361, 112.615, 125.795
Unit cell angles	90.00, 108.14, 90.00

Refinement procedure

Resolution	29.310 - 2.640
R-factor	0.2401
Rwork	0.240
R-free	0.25600
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	7xgv
RMSD bond length	0.007
RMSD bond angle	1.179
Data reduction software	xia2
Data scaling software	xia2
Phasing software	PHASER
Refinement software	PHENIX (1.18_3845)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	29.310	2.730
High resolution limit [Å]	2.640	2.640
Rmerge	0.130
Number of reflections	71942	68773
<I/σ(I)>	4.07
Completeness [%]	95.5
Redundancy	6.7
CC(1/2)	0.971	0.314

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		289	PEG