6DB5

Crystal structure of anti-HIV-1 V3 Fab TA6 in complex with a HIV-1 gp120 V3 peptide from NY5 strain

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS-II BEAMLINE 17-ID-1
Synchrotron site	NSLS-II
Beamline	17-ID-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-08-02
Detector	DECTRIS EIGER X 9M
Wavelength(s)	0.91979
Spacegroup name	P 1 21 1
Unit cell lengths	78.616, 67.361, 103.038
Unit cell angles	90.00, 100.25, 90.00

Refinement procedure

Resolution	29.790 - 2.599
R-factor	0.2304
Rwork	0.227
R-free	0.28270
RMSD bond length	0.002
RMSD bond angle	0.479
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX ((1.13_2998: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	29.790	2.692
High resolution limit [Å]	2.599	2.599
Rmerge	0.136	0.696
Number of reflections	32650
<I/σ(I)>	6.2
Completeness [%]	99.1
Redundancy	3.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		292	0.1 M Na Citrate pH 5.6, 1.5 M (NH4)2SO4, 5% Glycerol, and 15% Isopropanol