6SND

crystal structure of LN01 Fab in complex with an HIV-1 gp41 peptide

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID23-1
Synchrotron site	ESRF
Beamline	ID23-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-03-11
Detector	DECTRIS PILATUS 6M-F
Wavelength(s)	0.98
Spacegroup name	P 43 21 2
Unit cell lengths	137.707, 137.707, 146.719
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	47.170 - 3.100
R-factor	0.2397
Rwork	0.238
R-free	0.26680
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.003
RMSD bond angle	0.837
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHENIX
Refinement software	PHENIX (1.16_3549)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.910	3.310
High resolution limit [Å]	3.100	3.100
Rmerge	0.161	0.968
Rmeas	0.186
Rpim	0.090
Number of reflections	26213	4662
<I/σ(I)>	8.8	1.9
Completeness [%]	99.8
Redundancy	7.1
CC(1/2)	0.995	0.671

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	0.1 M Hepes pH 7,5 10% PEG 3350