8W53

Crystal structure of LbUGT 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	2023-06-19
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.979
Spacegroup name	P 2 21 21
Unit cell lengths	72.442, 80.841, 180.242
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	31.020 - 2.428
R-factor	0.221550163313
Rwork	0.219
R-free	0.26589
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.003
RMSD bond angle	0.670
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]	31.030	2.490
High resolution limit [Å]	2.428	2.428
Number of reflections	40772	2963
<I/σ(I)>	11.6
Completeness [%]	100.0	100
Redundancy	12.9	13.3
CC(1/2)	0.999	0.617

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6.5	292.2	100 mM Bis Tris propane, 200 mM Na fluoride and 20% PEG 3350