5YVJ

Crystal structure of full length NS2B47-NS3 (gD4NS2BNS3) from Dengue virus 4 in open conformation

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06DA
Synchrotron site	SLS
Beamline	X06DA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2014-11-21
Detector	DECTRIS PILATUS 2M-F
Wavelength(s)	1
Spacegroup name	P 1 21 1
Unit cell lengths	52.780, 86.810, 75.900
Unit cell angles	90.00, 93.07, 90.00

Refinement procedure

Resolution	45.051 - 2.508
R-factor	0.1907
Rwork	0.188
R-free	0.24560
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2vbc
RMSD bond length	0.005
RMSD bond angle	0.846
Data reduction software	iMOSFLM
Data scaling software	SCALA
Phasing software	PHASER
Refinement software	PHENIX (1.9_1692)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	45.051	2.640
High resolution limit [Å]	2.508	2.508
Rmerge	0.093	0.394
Rmeas	0.117	0.497
Rpim		0.299
Number of reflections	22654	2117
<I/σ(I)>	5.52	2.2
Completeness [%]	96.3	90.87
Redundancy	2.4	2.4
CC(1/2)	0.980	0.817

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6	291.15	0.1M MES pH7.5, 15% PEG 6000