5LKK

Protruding domain of GII.17 norovirus Kawasaki308 in complex with 3-fucosyllactose (3FL)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID29
Synchrotron site	ESRF
Beamline	ID29
Temperature [K]	100
Detector technology	PIXEL
Collection date	2016-04-29
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.96770
Spacegroup name	P 21 21 21
Unit cell lengths	75.140, 86.710, 96.170
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.897 - 1.490
R-factor	0.1328
Rwork	0.131
R-free	0.16390
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5fmo
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER (2.5.6)
Refinement software	REFMAC

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	48.900		1.520
High resolution limit [Å]	1.480	6.620	1.480
Rmerge	0.074	0.047	0.795
Number of reflections	103757
<I/σ(I)>	20.85	45.7	3.8
Completeness [%]	98.6	99.2	94.3
Redundancy	13.6
CC(1/2)	0.999	0.997	0.901

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8.5	291	Magnesium Chloride, PEG8000, Tris-HCl