6V6W

Crystal structure of antibody 438-B11 DSS mutant (Cys98A-100aA) in complex with an uncleaved prefusion optimized (UFO) soluble BG505 trimer and Fab 35O22

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	2018-11-05
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.97946
Spacegroup name	H 3
Unit cell lengths	148.534, 148.534, 843.554
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	46.720 - 6.500
R-factor	0.3112
Rwork	0.309
R-free	0.35520
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6utk
RMSD bond length	0.003
RMSD bond angle	0.643
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX (1.16_3549)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	6.620
High resolution limit [Å]	6.500	6.500
Rpim	0.090	0.640
Number of reflections	13313	638
<I/σ(I)>	1
Completeness [%]	97.5
Redundancy	4.2
CC(1/2)	0.850	0.620

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		277.15	12% 1-propanol, 0.1M MES (pH=6.5), 20% polyethylene glycol monomethyl ether 5000, 25% glycerol