9DMF

Crystal structure of LJF-0085 Fab, a non-human primate antibody targets HIV-1 envelope protein

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS-II BEAMLINE 17-ID-2
Synchrotron site	NSLS-II
Beamline	17-ID-2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2024-02-26
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.9793
Spacegroup name	P 21 21 21
Unit cell lengths	53.457, 65.355, 133.257
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	50.000 - 1.480
R-factor	0.1887
Rwork	0.188
R-free	0.19950
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.014
RMSD bond angle	1.371
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX (1.21rc1-5127)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	1.520
High resolution limit [Å]	1.480	1.480
Number of reflections	78472	5458
<I/σ(I)>	21.1	3.4
Completeness [%]	99.9
Redundancy	13.5
CC(1/2)	1.000	0.920

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293.15	0.04 M potassium dihydrogen phosphate, 20% (v/v) glycerol, and 16% (w/v) polyethylene glycol 8000