7ZWM

Pfs48/45 central and C-terminal domains bound to Fab fragments of monoclonal antibody 10D8 and 32F3

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I04-1
Synchrotron site	Diamond
Beamline	I04-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-04-29
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.91587
Spacegroup name	P 21 21 21
Unit cell lengths	108.583, 158.451, 186.163
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	93.790 - 3.690
R-factor	0.2565
Rwork	0.255
R-free	0.27980
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6h5n
RMSD bond length	0.004
RMSD bond angle	0.672
Data reduction software	xia2
Data scaling software	xia2
Phasing software	PHASER
Refinement software	BUSTER (1.19_4092)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	108.580	3.750
High resolution limit [Å]	3.690	3.690
Rpim	0.065	0.338
Number of reflections	230227	11072
<I/σ(I)>	7.2
Completeness [%]	100.0
Redundancy	6.5
CC(1/2)	0.971	0.438

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	10 % (w/v) PEG monomethyl ether 5000, 0.1M 2-(N-morpholino) ethanesulfonic acid pH 6.5 and 12% (v/v) 1-propanol