5VI7

Crystal structure of the Zika virus NS3 helicase

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 22-BM
Synchrotron site	APS
Beamline	22-BM
Temperature [K]	100
Detector technology	CCD
Collection date	2016-12-11
Detector	MARMOSAIC 300 mm CCD
Wavelength(s)	1.0
Spacegroup name	P 21 21 21
Unit cell lengths	43.606, 79.468, 119.769
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	39.734 - 2.005
R-factor	0.1671
Rwork	0.165
R-free	0.20710
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5k8u
RMSD bond length	0.003
RMSD bond angle	0.710
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	PHENIX (1.9_1692)
Refinement software	PHENIX (1.9_1692)

Data quality characteristics

	Overall
Low resolution limit [Å]	39.734
High resolution limit [Å]	2.005
Number of reflections	23840
<I/σ(I)>	2.61
Completeness [%]	83.1
Redundancy	5.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6.5	288	PEG 400, cacodylate, lithium sulfate