9GHI

Machupo virus GP1-GP2 heterodimer in complex with Fab of MAC1

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	2021-11-22
Detector	DECTRIS EIGER2 XE 9M
Wavelength(s)	0.9179
Spacegroup name	P 1 21 1
Unit cell lengths	46.682, 73.585, 184.958
Unit cell angles	90.00, 91.00, 90.00

Refinement procedure

Resolution	47.250 - 2.410
R-factor	0.232
Rwork	0.230
R-free	0.26780
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.003
RMSD bond angle	0.533
Data reduction software	xia2
Data scaling software	xia2
Phasing software	PHASER
Refinement software	PHENIX (1.21.1_5286)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	184.930	2.450
High resolution limit [Å]	2.410	2.410
Number of reflections	48718	2434
<I/σ(I)>	6.5
Completeness [%]	99.9
Redundancy	7
CC(1/2)	0.989	0.314

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293.65	90 mM Li2SO4, 90 mM Na2SO4, 90 mM K2SO4 12.5 % w/v PEG 4000, 20% w/v 1,2,6-Hexanetriol 0.1 M Gly-Gly/AMPD pH 8.5