6VBP

Crystal structure of anti-HIV-1 antibody DH815 bound to gp120 V2 peptide

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 22-ID
Synchrotron site	APS
Beamline	22-ID
Temperature [K]	100
Detector technology	CCD
Collection date	2017-08-02
Detector	RAYONIX MX300-HS
Wavelength(s)	1
Spacegroup name	P 1 21 1
Unit cell lengths	69.903, 158.531, 92.646
Unit cell angles	90.00, 110.27, 90.00

Refinement procedure

Resolution	45.152 - 2.298
R-factor	0.1815
Rwork	0.180
R-free	0.22870
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4kmt
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX (1.14_3228)
Refinement software	PHENIX (1.14_3228)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.350
High resolution limit [Å]	2.298	2.298
Rpim	0.075	0.483
Number of reflections	80681	6592
<I/σ(I)>	9.31
Completeness [%]	95.9	77.8
Redundancy	3	2.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	4.2	292	0.2M sodium chloride, 20% PEG 8000 and 0.1M sodium citrate pH 4.2.