9ZRO

Neutralizing W037 Fab antibody fragment in complex with West Nile Virus EDIII

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRL BEAMLINE BL12-2
Synchrotron site	SSRL
Beamline	BL12-2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2024-10-27
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.97946
Spacegroup name	P 21 21 2
Unit cell lengths	74.885, 158.861, 52.374
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	37.760 - 1.400
R-factor	0.1844
Rwork	0.184
R-free	0.21090
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.010
RMSD bond angle	1.168
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.21.2_5419+SVN)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	37.760	1.420
High resolution limit [Å]	1.400	1.400
Number of reflections	123650	6025
<I/σ(I)>	11.9
Completeness [%]	99.9
Redundancy	6.7
CC(1/2)	0.997	0.516

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		298	0.2 M Magnesium chloride hexahydrate, 20% w/v Polyethylene glycol 3,350