22ZV

norovirus GII23 P domain

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL19U1
Synchrotron site	SSRF
Beamline	BL19U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-10-18
Detector	DECTRIS PILATUS3 S 6M
Wavelength(s)	0.9792
Spacegroup name	P 21 21 21
Unit cell lengths	60.832, 107.313, 220.661
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	47.761 - 2.000
Rwork	0.182
R-free	0.22800
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.007
RMSD bond angle	1.397
Data reduction software	HKL-2000 (HLK-2000)
Data scaling software	HKL-2000 (HLK-2000)
Phasing software	PHENIX (PHENIX)
Refinement software	REFMAC (5.8.0415)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.030
High resolution limit [Å]	2.000	2.000
Number of reflections	98555	6811
<I/σ(I)>	13.4
Completeness [%]	100.0
Redundancy	9.8
CC(1/2)	0.997	0.872

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		291	10% (v/v) PEG 200, 0.1 M BIS-TRIS propane (pH 9.0), and 18% (w/v) PEG 8,000