7SBZ

JAR5 Fab bound to fHbp v1.1 crystallized in space group I422

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 22-ID
Synchrotron site	APS
Beamline	22-ID
Temperature [K]	173
Detector technology	PIXEL
Collection date	2020-08-11
Detector	DECTRIS EIGER X 16M
Wavelength(s)	1.0
Spacegroup name	I 41 2 2
Unit cell lengths	167.660, 167.660, 313.160
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	49.270 - 2.900
R-factor	0.2518
Rwork	0.248
R-free	0.29620
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5t5f
RMSD bond length	0.003
RMSD bond angle	0.609
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHENIX
Refinement software	PHENIX ((1.19.2_4158))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	49.270	3.004
High resolution limit [Å]	2.900	2.900
Rmerge	0.584	4.160
Rmeas	0.607	4.318
Number of reflections	49617	4851
<I/σ(I)>	9.48
Completeness [%]	96.8
Redundancy	13.3
CC(1/2)	0.996	0.649

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	0.1 M Cadmium Chloride 0.1 M Sodium Acetate pH 4.6 30% PEG 300