6Z2L

Structure of Plasmodium falciparum P113 bound to antibody P3.2

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I03
Synchrotron site	Diamond
Beamline	I03
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-12-04
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.9762
Spacegroup name	P 41 21 2
Unit cell lengths	96.921, 96.921, 177.898
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	96.920 - 1.950
R-factor	0.2058
Rwork	0.205
R-free	0.22570
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4u0r
RMSD bond length	0.013
RMSD bond angle	1.130
Data reduction software	autoPROC
Data scaling software	xia2
Phasing software	PHASER
Refinement software	BUSTER (2.10.3 (19-MAR-2020))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	96.920	2.000
High resolution limit [Å]	1.950	1.950
Rpim	0.042	1.422
Number of reflections	62581	4310
<I/σ(I)>	16.6	1.7
Completeness [%]	100.0	100
Redundancy	26.2	26.2
CC(1/2)	0.994	0.571

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		291	0.2M NH4SO4, 0.1M MES pH=6.5, 20% w/v PEG8000