9E7P

Pfs230 D13D14 in complex with nanobody W2812

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	2023-12-01
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.953728
Spacegroup name	P 41 21 2
Unit cell lengths	134.647, 134.647, 75.740
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	47.600 - 3.220
R-factor	0.2889
Rwork	0.286
R-free	0.31970
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.003
RMSD bond angle	0.602
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]	47.600	9.470	3.410
High resolution limit [Å]	3.220	6.770	3.220
Rmerge	0.077	0.035	0.796
Rmeas	0.131	0.054	1.470
Number of reflections	11793	843	1841
<I/σ(I)>	6
Completeness [%]	99.9
Redundancy	13.3
CC(1/2)	0.999	0.999	0.718

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		277	5% (w/v) PEG8000, 5% (w/v) PEG10000, 5% (w/v) PEG 6000, 0.15M ammonium acetate, 0.1 M sodium citrate pH 5.0