8J66

Crystal structure of glycosyltransferase SgUGT94-289-3 in complex with M3, state 2

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL19U1
Synchrotron site	SSRF
Beamline	BL19U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2023-04-14
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.97918
Spacegroup name	P 21 21 21
Unit cell lengths	72.068, 78.127, 94.653
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	47.330 - 2.270
R-factor	0.2081
Rwork	0.207
R-free	0.23410
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.009
RMSD bond angle	1.382
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHENIX
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	47.330	2.356
High resolution limit [Å]	2.270	2.275
Number of reflections	24762	2392
<I/σ(I)>	11.23
Completeness [%]	98.1
Redundancy	4.7
CC(1/2)	0.986	0.504

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		289.15	0.2 M Sodium iodide, 20% w/v Polyethylene glycol 3,350, pH 7.0