6WOS

Structure of broadly neutralizing antibody AR3B

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	2017-04-02
Detector	DECTRIS PILATUS3 S 6M
Wavelength(s)	1.0332
Spacegroup name	C 1 2 1
Unit cell lengths	46.341, 72.167, 135.468
Unit cell angles	90.00, 91.20, 90.00

Refinement procedure

Resolution	29.768 - 1.645
R-factor	0.1955
Rwork	0.194
R-free	0.23170
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6bkc
RMSD bond length	0.006
RMSD bond angle	0.854
Data reduction software	HKL-2000
Data scaling software	SCALEPACK
Phasing software	PHASER
Refinement software	PHENIX (1.12_2829)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	35.000	1.680
High resolution limit [Å]	1.645	1.645
Number of reflections	52082	1976
<I/σ(I)>	24.2
Completeness [%]	96.5
Redundancy	2.6
CC(1/2)	0.920	0.720

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	20% (w/v) PEG 3350, 0.2M Na thiocyanate, 10% ethylene glycol