6DFI

Crystal structure of anti-Zika antibody Z021 bound to Zika virus envelope protein DIII

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 23-ID-D
Synchrotron site	APS
Beamline	23-ID-D
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-10-28
Detector	DECTRIS PILATUS 6M
Wavelength(s)	1.0
Spacegroup name	P 21 21 21
Unit cell lengths	73.881, 105.622, 107.240
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	75.250 - 2.480
R-factor	0.1842
Rwork	0.182
R-free	0.22850
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.008
RMSD bond angle	0.910
Data reduction software	MOSFLM
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.13_2998)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	75.250	2.570
High resolution limit [Å]	2.480	2.480
Rmerge	0.091	0.486
Rpim	0.077	0.418
Number of reflections	30524	3427
<I/σ(I)>	7.8	2.2
Completeness [%]	99.7	99.9
Redundancy	3.7	3.7
CC(1/2)	0.993	0.696

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7	295	0.1M HEPES pH 7.0, 29% PEG 1000