8HJG

Crystal structure of glycosyltransferase SgUGT94-289-3 in complex with M5, state 1

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL18U1
Synchrotron site	SSRF
Beamline	BL18U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-06-06
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.97918
Spacegroup name	P 1 21 1
Unit cell lengths	78.178, 76.483, 82.182
Unit cell angles	90.00, 92.64, 90.00

Refinement procedure

Resolution	19.650 - 1.700
R-factor	0.1801
Rwork	0.180
R-free	0.19060
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6jtd
RMSD bond length	0.010
RMSD bond angle	1.310
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHENIX
Refinement software	PHENIX (1.18.2_3874)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	19.650	1.761
High resolution limit [Å]	1.700	1.700
Number of reflections	102616	10112
<I/σ(I)>	18.36
Completeness [%]	94.9
Redundancy	6.9
CC(1/2)	0.999	0.916

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		289.15	Tris-HCl, polyethylene glycol 3350, NaCl, Polypropylene glycol P400.