5OW2

Japanese encephalitis virus capsid protein

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I04
Synchrotron site	Diamond
Beamline	I04
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-07-01
Detector	DECTRIS PILATUS3 S 6M
Wavelength(s)	0.928
Spacegroup name	P 21 21 21
Unit cell lengths	46.310, 49.780, 68.250
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	38.320 - 1.980
R-factor	0.19026
Rwork	0.188
R-free	0.23731
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1sfk
RMSD bond length	0.014
RMSD bond angle	1.428
Data reduction software	xia2
Data scaling software	xia2
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0135)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	38.320	2.030
High resolution limit [Å]	1.980	1.980
Rmerge	0.058	0.862
Rpim	0.440	0.686
Number of reflections	11457	821
<I/σ(I)>	12.1	1.4
Completeness [%]	99.6	99
Redundancy	4.5	4.3
CC(1/2)	0.999	0.551

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		298	18% v/v 2-propanol, 0.1 M sodium citrate tribasic dihydrate pH 5.6, 16 % w/v polyethylene glycol 4,000.