9UIX

Plasmodium vivax cytoplasmic Phenylalanyl-tRNA synthetase in complex with Phenylalanine in space group P212121

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	2022-11-25
Detector	DECTRIS EIGER2 XE 16M
Wavelength(s)	0.97627
Spacegroup name	P 21 21 21
Unit cell lengths	136.372, 157.105, 190.805
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	110.950 - 3.260
R-factor	0.2219
Rwork	0.221
R-free	0.24600
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	7by6
RMSD bond length	0.002
RMSD bond angle	0.520
Data reduction software	autoPROC
Data scaling software	autoPROC
Phasing software	PHASER
Refinement software	PHENIX ((1.21.2_5419: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	121.280	3.320
High resolution limit [Å]	3.260	3.260
Rmeas	0.380	5.507
Number of reflections	64442	3180
<I/σ(I)>	6.7
Completeness [%]	99.6	99.9
Redundancy	14	14.6
CC(1/2)	1.000	0.325

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	0.02 M Zinc chloride, 20% w/v Polyethylene glycol 3,350 (PEG Ion H8)