5F4O

Protruding domain of GII.17 norovirus Kawasaki308

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID23-2
Synchrotron site	ESRF
Beamline	ID23-2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2015-10-13
Detector	DECTRIS PILATUS3 2M
Wavelength(s)	0.87260
Spacegroup name	P 21 21 21
Unit cell lengths	75.720, 86.970, 97.350
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	43.485 - 1.590
R-factor	0.1526
Rwork	0.151
R-free	0.17400
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5f4m
RMSD bond length	0.008
RMSD bond angle	1.189
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER (2.5.6)
Refinement software	PHENIX

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	43.485		1.620
High resolution limit [Å]	1.580	7.060	1.580
Rmerge	0.066	0.026	0.712
Rmeas	0.076	0.030	0.826
Total number of observations	333283
Number of reflections	85727	1042	6176
<I/σ(I)>	11.75	36.67	1.68
Completeness [%]	96.5	91.2	95.4
Redundancy	3.9

Crystallization Conditions

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