6OZ4

Crystal structure of broadly neutralizing antibody N49P6 Fab in complex with HIV-1 BG505 SOSIP.664 Env trimer 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	2018-11-09
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.97946
Spacegroup name	P 21 3
Unit cell lengths	164.703, 164.703, 164.703
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	39.946 - 4.050
R-factor	0.2578
Rwork	0.255
R-free	0.31460
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4tvp 6bck
RMSD bond length	0.008
RMSD bond angle	1.216
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX ((1.15.2_3472: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	4.120
High resolution limit [Å]	4.050	4.050
Rmerge	0.113
Rpim	0.053	0.757
Number of reflections	12543	608
<I/σ(I)>	22.8	1
Completeness [%]	99.6	99.8
Redundancy	5.5	4.6
CC(1/2)		0.480

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8	294	12% PEG 3350 0.1 M Tris-HCl pH 8.0