9OFT

Rotavirus NSP2 WT

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU MICROMAX-007
Temperature [K]	100
Detector technology	PIXEL
Collection date	2024-04-23
Detector	DECTRIS PILATUS 300K
Wavelength(s)	1.54
Spacegroup name	I 4 2 2
Unit cell lengths	108.673, 108.673, 153.416
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	34.390 - 2.950
R-factor	0.23186
Rwork	0.228
R-free	0.26608
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.005
RMSD bond angle	0.822
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	PHENIX
Refinement software	REFMAC (1.20.1_4487)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	35.000	35.000	3.040
High resolution limit [Å]	2.950	6.740	2.950
Rmerge	0.172	0.059	0.601
Rmeas	0.179	0.063	0.625
Rpim	0.051	0.019	0.170
Total number of observations	121329
Number of reflections	10045	919	822
<I/σ(I)>	5.6
Completeness [%]	100.0	100	100
Redundancy	12.1	9.7	13.3
CC(1/2)	0.997	0.998	0.934

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	100 mM Tris-HCl pH 7.5, 0.2M MgAc, 12% PEG6K