8HOJ

Crystal structure of UGT71AP2 in complex with UDP

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	2019-05-24
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.979
Spacegroup name	P 21 21 2
Unit cell lengths	104.728, 108.544, 84.350
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	27.460 - 2.900
R-factor	0.2287
Rwork	0.226
R-free	0.28440
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2acw
Data reduction software	DENZO
Data scaling software	HKL-2000
Phasing software	PHASES
Refinement software	PHENIX (1.19_4092)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	40.000	40.000	2.950
High resolution limit [Å]	2.900	7.850	2.900
Rmerge	0.121	0.039	0.791
Rmeas	0.137	0.045	0.895
Rpim	0.063	0.021	0.410
Total number of observations	100532
Number of reflections	21963	1208	1067
<I/σ(I)>	4.7
Completeness [%]	99.7	99.2	99.8
Redundancy	4.6	4	4.7
CC(1/2)		0.997	0.822

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		283	0.2 M Ammonium tartrate dibasic, 20% w/v Polyethylene glycol 3,350