5TBD

Crystal Structure of anti-MSP2 Fv fragment (mAb4D11) in complex with 3D7-MSP2 215-222

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	AUSTRALIAN SYNCHROTRON BEAMLINE MX1
Synchrotron site	Australian Synchrotron
Beamline	MX1
Temperature [K]	100
Detector technology	CCD
Collection date	2015-08-19
Detector	ADSC QUANTUM 210r
Wavelength(s)	0.9537
Spacegroup name	P 1
Unit cell lengths	41.975, 72.970, 81.965
Unit cell angles	68.19, 78.75, 73.83

Refinement procedure

Resolution	32.050 - 2.200
R-factor	0.2086
Rwork	0.207
R-free	0.24700
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4qyo
RMSD bond length	0.003
RMSD bond angle	0.682
Data reduction software	iMOSFLM
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.8.4_1496)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	32.050	2.270
High resolution limit [Å]	2.200	2.200
Rmerge	0.258	1.094
Number of reflections	4359
<I/σ(I)>	7.5	2.6
Completeness [%]	100.0	100
Redundancy	7.3	7.3
CC(1/2)	0.986	0.683

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6	293	23% (w/v) PEG3350 0.1 M BIS TRIS (pH 6.0) 0.2 M MgCl2