7EVV

Co-crystal Structure of Toxoplasma gondii Prolyl tRNA Synthetase (TgPRS) in complex with JE6 and L-pro

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SOLEIL BEAMLINE PROXIMA 1
Synchrotron site	SOLEIL
Beamline	PROXIMA 1
Temperature [K]	298
Detector technology	PIXEL
Collection date	2017-10-04
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.979
Spacegroup name	C 1 2 1
Unit cell lengths	111.350, 75.200, 74.740
Unit cell angles	90.00, 110.74, 90.00

Refinement procedure

Resolution	31.516 - 1.704
R-factor	0.1546
Rwork	0.153
R-free	0.18060
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6aa0
Data reduction software	DIALS
Data scaling software	DIALS
Phasing software	PHASER
Refinement software	PHENIX (1.15rc2_3428)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	41.850	1.710
High resolution limit [Å]	1.700	1.700
Rmeas	0.089	0.602
Number of reflections	62494	9672
<I/σ(I)>	13.3
Completeness [%]	99.1
Redundancy	2.2
CC(1/2)	0.992	0.868

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		298	JCSG+ B5