8PXJ

Structure of Whitewater Arroyo virus GP1 glycoprotein, solved at wavelength 2.75 A

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I23
Synchrotron site	Diamond
Beamline	I23
Temperature [K]	80
Detector technology	PIXEL
Collection date	2016-07-20
Detector	DECTRIS PILATUS 12M
Wavelength(s)	2.7552
Spacegroup name	P 63 2 2
Unit cell lengths	106.830, 106.830, 74.860
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	46.300 - 2.750
R-factor	0.25059
Rwork	0.249
R-free	0.27618
Structure solution method	SAD
RMSD bond length	0.014
RMSD bond angle	1.176
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	HKL2Map
Refinement software	REFMAC (5.8.0403)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	46.300	2.848
High resolution limit [Å]	2.750	2.750
Rmerge	0.140
Rmeas	0.143
Rpim	0.025
Number of reflections	6783	608
<I/σ(I)>	21.54	0.88
Completeness [%]	97.2
Redundancy	30.7
CC(1/2)	0.999	0.567

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		298	1.0 mg/ml protein, 0.1 M HEPES-Na pH 7.5, and 0.05 M cadmium sulphate