4BZ1

Structure of dengue virus EDIII in complex with Fab 3e31

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	AUSTRALIAN SYNCHROTRON BEAMLINE MX1
Synchrotron site	Australian Synchrotron
Beamline	MX1
Temperature [K]	100
Detector technology	CCD
Collection date	2011-10-13
Detector	ADSC QUANTUM 210r
Spacegroup name	P 2 21 21
Unit cell lengths	39.802, 107.009, 134.896
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	53.504 - 2.150
R-factor	0.225
Rwork	0.223
R-free	0.25460
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2r29
RMSD bond length	0.003
RMSD bond angle	0.739
Data reduction software	XDS
Data scaling software	SCALA
Phasing software	PHASER
Refinement software	PHENIX ((PHENIX.REFINE))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	57.060	2.270
High resolution limit [Å]	2.150	2.150
Rmerge	0.110
Number of reflections	32253
<I/σ(I)>	19.54	2.1
Completeness [%]	99.9	99
Redundancy	14	11.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1				0.01 M ZINC CHLORIDE, 0.1 M SODIUM ACETATE PH 5.0, 20% (W/V) PEG 6000