7BY6

Plasmodium vivax cytoplasmic Phenylalanyl-tRNA synthetase in complex with BRD1389

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I02
Synchrotron site	Diamond
Beamline	I02
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-04-12
Detector	DECTRIS PILATUS3 S 6M
Wavelength(s)	0.9688
Spacegroup name	P 21 21 2
Unit cell lengths	136.523, 74.071, 121.682
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	121.782 - 2.997
R-factor	0.2176
Rwork	0.214
R-free	0.28820
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3l4g
Data reduction software	DIALS
Data scaling software	xia2
Phasing software	PHASER
Refinement software	PHENIX (1.15rc1_3423)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	136.500	3.050
High resolution limit [Å]	2.997	3.000
Rmeas	0.145	1.288
Number of reflections	25453	1186
<I/σ(I)>	8.5	1.6
Completeness [%]	99.6	94.6
Redundancy	6.3	6.3
CC(1/2)	0.921	0.741

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	293	0.1 M sodium cacodylate, 3% w/v poly-gama-glutamic acid (Na+ form, low molecular weight), 3% w/v PEG20000, 0.1 M ammonium sulphate, 0.3 M sodium formate