7XGV

Legionella glucosyltransferase

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17B1
Synchrotron site	SSRF
Beamline	BL17B1
Temperature [K]	80
Detector technology	CCD
Collection date	2020-10-30
Detector	APEX II CCD
Wavelength(s)	0.979
Spacegroup name	P 1 21 1
Unit cell lengths	75.181, 76.014, 126.579
Unit cell angles	90.00, 90.30, 90.00

Refinement procedure

Resolution	29.220 - 2.270
R-factor	0.2073
Rwork	0.206
R-free	0.25300
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3jsz
Data reduction software	autoPROC
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.18_3845)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	29.220	2.351
High resolution limit [Å]	2.270	2.270
Rmerge	0.022	0.247
Rmeas	0.032	0.350
Rpim	0.022	0.247
Number of reflections	66028	64406
<I/σ(I)>	16.27	2.6
Completeness [%]	97.3	92.6
Redundancy	2	2
CC(1/2)	0.999	0.951

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		289	PEG3350, Calcium acetate hydrate