6PNT

Structural Characterization of UDP-glycosyltransferase from Tetranychus Urticae

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 22-ID
Synchrotron site	APS
Beamline	22-ID
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-04-05
Detector	DECTRIS EIGER X 16M
Wavelength(s)	1.0000
Spacegroup name	P 31 2 1
Unit cell lengths	77.481, 77.481, 130.953
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	29.880 - 1.850
R-factor	0.1701
Rwork	0.168
R-free	0.20790
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2iya
RMSD bond length	0.017
RMSD bond angle	2.042
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0253)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	40.000	1.880
High resolution limit [Å]	1.850	1.850
Rmerge	0.083	0.627
Rmeas	0.090	0.684
Rpim	0.032	0.267
Number of reflections	39554	1947
<I/σ(I)>	33.32	1.9
Completeness [%]	99.3	99.2
Redundancy	8.2	6.2
CC(1/2)		0.731

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7	277	5% Tacsimate pH 7.0, 0.1 M HEPES pH 7.0, 10% PEG 5000