6T4D

Crystal structure of Plasmodium falciparum Morn1

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID29
Synchrotron site	ESRF
Beamline	ID29
Temperature [K]	100
Detector technology	PIXEL
Collection date	2016-05-12
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.976
Spacegroup name	C 2 2 21
Unit cell lengths	57.327, 79.175, 94.417
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	41.670 - 2.140
R-factor	0.2317
Rwork	0.229
R-free	0.27480
Structure solution method	SAD
RMSD bond length	0.002
RMSD bond angle	0.482
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHENIX
Refinement software	PHENIX (1.17_3644)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	46.430	2.200
High resolution limit [Å]	2.140	2.140
Rmerge	0.031	1.065
Rmeas	0.040	1.394
Rpim	0.024	0.888
Number of reflections	12148	985
<I/σ(I)>	17.5	0.8
Completeness [%]	99.6	98.1
Redundancy	4.2	3.2
CC(1/2)	1.000	0.467

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8.5	295.15	2 mM divalents mix (0.5 mM MnCl3, 0.5 mM CoCl2, 0.5 mM NiCl2, 0.5 mM Zn(OAc)2, 0.1 M Buffer System 6, pH 8.5 (Gly-Gly, AMPD), and 50% precipitation Mix 7 (20 % PEG 8000, 40% 1,5-Pentanediol)