8QUS

Crystal structure of the Plasmodium vivax Apical membrane antigen (AMA1) in complex with single domain i-body WD34

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	2022-10-20
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.95372
Spacegroup name	P 21 21 21
Unit cell lengths	44.386, 55.265, 229.549
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	44.800 - 3.000
R-factor	0.2555
Rwork	0.254
R-free	0.28630
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.002
RMSD bond angle	0.458
Data reduction software	DIALS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	45.900	3.180
High resolution limit [Å]	3.000	3.000
Rmerge	0.130
Number of reflections	11653	8213
<I/σ(I)>	4.6
Completeness [%]	97.8
Redundancy	4.4
CC(1/2)	0.995	0.829

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293.15	0.1 M MES pH 6.5, 12% w/v PEG 20000, 20% Ethylene Glycol