7A3T

Crystal structure of dengue 3 virus envelope glycoprotein in complex with the Fab fragment of the broadly neutralizing human antibody EDE1 C8

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SOLEIL BEAMLINE PROXIMA 2
Synchrotron site	SOLEIL
Beamline	PROXIMA 2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2016-12-06
Detector	DECTRIS EIGER X 9M
Wavelength(s)	1.0
Spacegroup name	P 31 2 1
Unit cell lengths	110.309, 110.309, 217.337
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	29.530 - 2.650
R-factor	0.2096
Rwork	0.207
R-free	0.25400
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	D_1292109938 and 4UTA
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHENIX (1.17.1_3660)
Refinement software	PHENIX (1.17.1_3660)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	49.150	2.750
High resolution limit [Å]	2.650	2.650
Rmerge	0.320
Number of reflections	44949	4497
<I/σ(I)>	5.1	0.4
Completeness [%]	99.5	95.8
Redundancy	11.5
CC(1/2)	0.990	0.095

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		291	100 mM Na3 Citrate pH 5.6, 15% w/v PEG 4,000, 200 mM (NH4)2 SO4