8POS

Crystal structure of wolbachia leucyl-tRNA synthetase editing domain bound to cmpd9-AMP adduct

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID23-2
Synchrotron site	ESRF
Beamline	ID23-2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2022-01-28
Detector	DECTRIS PILATUS3 2M
Wavelength(s)	0.87313
Spacegroup name	P 43 21 2
Unit cell lengths	52.147, 52.147, 273.558
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	19.510 - 2.137
R-factor	0.2137
Rwork	0.212
R-free	0.25250
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.007
RMSD bond angle	0.910
Data reduction software	autoPROC (1.0.5)
Data scaling software	STARANISO
Phasing software	PHASER
Refinement software	BUSTER (2.10.4)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	51.224	2.386
High resolution limit [Å]	2.137	2.137
Rpim	0.040	0.478
Number of reflections	15552	777
<I/σ(I)>	12.1	1.7
Completeness [%]	93.0
Redundancy	29.5
CC(1/2)	0.999	0.776

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8.5	293	0.1 M Tris pH 8.5, 0.2 M LiSO4 ; 31% PEG 4000