8WP5

Crystal structure of LbUGT1 in complex with UDP

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	2023-09-21
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.979
Spacegroup name	P 43 21 2
Unit cell lengths	122.240, 122.240, 81.520
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.902 - 2.570
R-factor	0.247081308695
Rwork	0.243
R-free	0.28562
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.003
RMSD bond angle	0.643
Data reduction software	xia2
Data scaling software	xia2
Phasing software	PHENIX (1.11.1_2575)
Refinement software	PHENIX (1.11.1_2575)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.902	2.640
High resolution limit [Å]	2.570	2.570
Number of reflections	20277	1468
<I/σ(I)>	18.2
Completeness [%]	100.0
Redundancy	25.6
CC(1/2)	0.999	0.794

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	292.2	100 mM HEPES sodium hydroxide, 200 mM Ammonium sulfate, 10% 2-propanol, 20% PEG 8000