9E7N

Pfs230 D13D14 in complex with nanobody W2809

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	AUSTRALIAN SYNCHROTRON BEAMLINE MX2
Synchrotron site	Australian Synchrotron
Beamline	MX2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2024-09-28
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.953732
Spacegroup name	P 43 21 2
Unit cell lengths	79.919, 79.919, 342.703
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	47.170 - 2.490
R-factor	0.2257
Rwork	0.224
R-free	0.26430
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.004
RMSD bond angle	0.672
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX ((1.21.1_5286: ???))

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	47.170	7.400	2.640
High resolution limit [Å]	2.490	5.260	2.490
Rmerge	0.104	0.055	1.158
Rmeas	0.164	0.084	2.324
Number of reflections	39958	2851	6222
<I/σ(I)>	16.1
Completeness [%]	99.9
Redundancy	26.6
CC(1/2)	0.999	0.999	0.693

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	12% (w/v) polyethylene glycol (PEG) 8000, 4% (v/v) glycerol 0.2 M sodium acetate, 0.1 M imidazole pH 8.0