7RFB

Crystal structure of broadly neutralizing antibody mAb1198 in complex with Hepatitis C virus envelope glycoprotein E2 ectodomain

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	2021-01-09
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.98
Spacegroup name	P 1 21 1
Unit cell lengths	68.090, 102.431, 131.520
Unit cell angles	90.00, 92.73, 90.00

Refinement procedure

Resolution	46.160 - 2.700
R-factor	0.2171
Rwork	0.215
R-free	0.26170
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	PDB entries 6MEH & 6MEI
Data reduction software	MOSFLM
Data scaling software	Aimless (0.7.4)
Phasing software	PHASER
Refinement software	PHENIX (1.18.2_3874)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	80.780	80.780	2.790
High resolution limit [Å]	2.700	10.800	2.700
Rmerge	0.093	0.082	0.888
Rmeas	0.111	0.097	1.069
Rpim	0.060	0.052	0.586
Total number of observations	148614	2394	13869
Number of reflections	47758	787	4418
<I/σ(I)>	6.4	10	1.5
Completeness [%]	96.3	95.5	97.4
Redundancy	3.1	3	3.1
CC(1/2)	0.991	0.989	0.610

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	5.5	298	0.1 M ammonium acetate, 0.1 M Bis-Tris, pH 5.5, 17% PEG10000