5CJX

Crystal structure of 8ANC195 Fab in complex with BG505 SOSIP.664 HIV-1 Env trimer

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 23-ID-D
Synchrotron site	APS
Beamline	23-ID-D
Temperature [K]	100
Detector technology	PIXEL
Collection date	2014-11-07
Detector	DECTRIS PILATUS 6M
Wavelength(s)	1.0332
Spacegroup name	P 1 21 1
Unit cell lengths	117.739, 195.224, 119.094
Unit cell angles	90.00, 101.60, 90.00

Refinement procedure

Resolution	29.735 - 3.584
R-factor	0.2401
Rwork	0.239
R-free	0.28620
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	PDB entries 4TVP & 4P9M
RMSD bond length	0.007
RMSD bond angle	0.859
Data reduction software	XDS
Data scaling software	Aimless (0.3.11)
Phasing software	PHASER (2.5.6)
Refinement software	PHENIX ((1.10pre_2100: ???))

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	29.735	29.760	3.730
High resolution limit [Å]	3.584	15.840	3.584
Rmerge	0.071	0.016	0.753
Rpim	0.045	0.011	0.492
Total number of observations	201456	2121	12959
Number of reflections	61166
<I/σ(I)>	14.4	66.8	1.7
Completeness [%]	98.9	85.1	88.9
Redundancy	3.4	3.3	3.2
CC(1/2)	0.999	0.999	0.554

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION	8	298	0.1 M Tris, pH 8.0, 15% PEG3350, 2% v/v 1,4-dioxane