5F4J

Protruding domain of GII.17 norovirus Saitama/T87

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	C 2 2 21
Unit cell lengths	73.300, 100.750, 83.370
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.308 - 1.933
R-factor	0.1678
Rwork	0.166
R-free	0.19750
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5F4M chain A
RMSD bond length	0.006
RMSD bond angle	0.991
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]	48.310		1.980
High resolution limit [Å]	1.930	8.640	1.930
Rmerge	0.095	0.034	0.808
Rmeas	0.108	0.039	0.912
Total number of observations	106349
Number of reflections	23291	294	1652
<I/σ(I)>	11.32	33.48	1.96
Completeness [%]	99.2	95.1	95.9
Redundancy	4.6

Crystallization Conditions

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