5MZO

UDP-Glucose Glycoprotein Glucosyltransferase from Chaetomium thermophilum (open conformation)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I04-1
Synchrotron site	Diamond
Beamline	I04-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2015-02-15
Detector	DECTRIS PILATUS3 S 6M
Wavelength(s)	0.91741
Spacegroup name	P 61 2 2
Unit cell lengths	163.570, 163.570, 248.584
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	102.000 - 3.480
R-factor	0.252
Rwork	0.251
R-free	0.27800
Starting model (for MR)	5mu1
RMSD bond length	0.009
RMSD bond angle	1.210
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	BUSTER (2.10.3)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	124.290	3.680
High resolution limit [Å]	3.480	3.480
Rmerge	0.250	3.180
Rpim	0.100	1.290
Number of reflections	25652	3643
<I/σ(I)>	9.2	0.8
Completeness [%]	100.0	99.9
Redundancy	11.8	12.2
CC(1/2)	0.997	0.490

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8.5	291	24 mM Morpheus alchools mix, 20 mM Morpheus buffer system 3 pH 8.5, 2.5% v/v MPD, 2.5% w/v PEG 1000, 2.5% w/v PEG 3350, 1.6 mM CaCl2 and 50 uM UDP-glucose