5WDX

Structure of NS3 from HCV strain JFH-1 that is an unusually robust helicase that is primed to bind and unwind viral RNA

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 24-ID-E
Synchrotron site	APS
Beamline	24-ID-E
Temperature [K]	80
Detector technology	CCD
Collection date	2016-02-12
Detector	ADSC QUANTUM 315
Wavelength(s)	0.979
Spacegroup name	P 21 21 21
Unit cell lengths	72.312, 89.415, 98.714
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	58.330 - 2.230
Rwork	0.212
R-free	0.23800
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3o8b
RMSD bond length	0.003
RMSD bond angle	0.812
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX ((dev_2034: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	58.330	2.310
High resolution limit [Å]	2.230	2.230
Rmerge	0.195
Rpim	0.069	0.791
Number of reflections	31814
<I/σ(I)>	10.8
Completeness [%]	100.0	99.9
Redundancy	8.8	7.3
CC(1/2)	0.920	0.880

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		291	0.1M Bis-tris pH 8.5, 20% PEG3350 and 0.2 M sodium bromide