6Y6I

lipopolysaccharide outer core galactosyltransferase WaaB and UDP complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I03
Synchrotron site	Diamond
Beamline	I03
Temperature [K]	81
Detector technology	CCD
Collection date	2015-02-09
Detector	ADSC QUANTUM 4
Wavelength(s)	0.979
Spacegroup name	P 43 21 2
Unit cell lengths	104.440, 104.440, 89.640
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	73.850 - 1.920
R-factor	0.1662
Rwork	0.164
R-free	0.21340
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6y6g
RMSD bond length	0.008
RMSD bond angle	1.375
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	REFMAC (5.8.0258)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	73.850	1.989
High resolution limit [Å]	1.920	1.920
Rmerge	0.160	1.330
Number of reflections	38400	3752
<I/σ(I)>	16.1
Completeness [%]	99.9	99.5
Redundancy	23.4	11.8
CC(1/2)	1.000	0.500

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7	293	1% tryptone, 1mM sodium azide, 0.05M HEPES pH7.0 and 20% w/v PEG 3350