9B8G

2C9 Fab antibody fragment against the E protein of the Yellow Fever virus

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	AUSTRALIAN SYNCHROTRON BEAMLINE MX2
Synchrotron site	Australian Synchrotron
Beamline	MX2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-08-18
Detector	DECTRIS EIGER2 S 16M
Wavelength(s)	0.95373
Spacegroup name	P 1 21 1
Unit cell lengths	67.667, 125.329, 96.928
Unit cell angles	90.00, 93.95, 90.00

Refinement procedure

Resolution	49.320 - 2.660
R-factor	0.2035
Rwork	0.201
R-free	0.25840
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.006
RMSD bond angle	0.822
Data reduction software	XDS
Data scaling software	Aimless (CCP4 7.1.015)
Phasing software	PHASER (2.8.3)
Refinement software	PHENIX (1.21_5207)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	49.320	2.750
High resolution limit [Å]	2.660	2.660
Rmerge	0.321	3.141
Rpim	0.129	1.163
Number of reflections	46392	4537
<I/σ(I)>	7.1	1.5
Completeness [%]	100.0	99.9
Redundancy	7.1	7.3
CC(1/2)	0.980	0.403

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7	293.15	1.3 M (NH4)2SO4, 0.1 M HEPES pH 7.0, 0.1 M NaCl