5WZ3

Crystal structure of Zika virus NS5 RNA-dependent RNA polymerase(RdRP)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U
Synchrotron site	SSRF
Beamline	BL17U
Temperature [K]	100
Detector technology	CCD
Collection date	2016-10-10
Detector	ADSC QUANTUM 315
Wavelength(s)	0.72929
Spacegroup name	P 1 21 1
Unit cell lengths	63.528, 84.851, 69.199
Unit cell angles	90.00, 113.37, 90.00

Refinement procedure

Resolution	34.159 - 1.804
R-factor	0.1798
Rwork	0.178
R-free	0.20610
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2j7u
RMSD bond length	0.005
RMSD bond angle	0.958
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX (1.9_1692)

Data quality characteristics

	Overall
Low resolution limit [Å]	50.000
High resolution limit [Å]	1.800
Rmerge	0.078
Number of reflections	61460
<I/σ(I)>	22.098
Completeness [%]	98.5
Redundancy	6.1
CC(1/2)	0.994

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8.5	291	20 mM D-glucose, 20 mM D-mannose, 20 mM D-galactose, 20 mM L-fucose, 20 mM D-xylose, 20 mM N-acetyl-D-glucosamine, 60.9 mM Tris (base), 39.1 mM Bicine, pH 8.5, 12 % v/v ethylene glycol and 6 % w/v PEG 8000