6OE4

Prefusion RSV F monomer bound by neutralizing antibody CR9501

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 19-ID
Synchrotron site	APS
Beamline	19-ID
Temperature [K]	100
Detector technology	PIXEL
Collection date	2016-11-08
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.9792
Spacegroup name	P 21 21 21
Unit cell lengths	105.628, 153.389, 155.529
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	52.814 - 3.300
R-factor	0.2139
Rwork	0.212
R-free	0.25930
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.004
RMSD bond angle	0.870
Data reduction software	iMOSFLM (7.2.1)
Data scaling software	Aimless (0.5.28)
Phasing software	PHASER (2.6.1)
Refinement software	PHENIX (1.12_2829)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	53.000	52.810	3.450
High resolution limit [Å]	3.300	11.430	3.300
Rmerge	0.394	0.076	1.757
Rmeas	0.431	0.085	1.918
Rpim	0.173	0.036	0.761
Number of reflections	38582	1029	4628
<I/σ(I)>	5.8
Completeness [%]	99.7	98.1	99.7
Redundancy	6.1	5.1	6.5
CC(1/2)	0.963	0.995	0.539

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	4.2mg/mL monomeric prefusion F (DS-Cav1) + CR9501 Fab, 14.3% (w/v) PEG8000, 2.4% (v/v) 2-methyl-2,4-pentanediol (MPD), 0.1 M sodium citrate pH 5.5, 0.1 M sodium malonate pH 7.0