6J00

The RNA-dependent RNA polymerase domain of dengue 3 NS5

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SPRING-8 BEAMLINE BL26B2
Synchrotron site	SPring-8
Beamline	BL26B2
Temperature [K]	100
Detector technology	CCD
Collection date	2016-09-30
Detector	MARMOSAIC 225 mm CCD
Wavelength(s)	1
Spacegroup name	C 2 2 21
Unit cell lengths	161.520, 177.360, 58.010
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	51.519 - 2.140
R-factor	0.2206
Rwork	0.219
R-free	0.24980
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2j7u
Data reduction software	xia2
Data scaling software	xia2
Phasing software	PHENIX
Refinement software	PHENIX (1.12_2829)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	62.700	2.200
High resolution limit [Å]	2.140	2.140
Number of reflections	46398	3359
<I/σ(I)>	12.06
Completeness [%]	99.9
Redundancy	7.4
CC(1/2)	0.998	0.616

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	16% polyethylene glycol 10000 and 100 mM Tris-HCl (pH 8.0)