8OI9

Trichomonas vaginalis riboside hydrolase in complex with 5-methyluridine

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID23-1
Synchrotron site	ESRF
Beamline	ID23-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-01-25
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.9724
Spacegroup name	P 43 2 2
Unit cell lengths	92.490, 92.490, 186.884
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	46.288 - 1.950
Rwork	0.173
R-free	0.20360
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.004
RMSD bond angle	1.029
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	REFMAC (5.8.0405)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	46.288	2.000
High resolution limit [Å]	1.950	1.950
Rpim	0.059	1.112
Number of reflections	59963	4118
<I/σ(I)>	11.5	1.3
Completeness [%]	100.0
Redundancy	13.2
CC(1/2)	0.999	0.537

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		291.15	90 mM PIPES pH 7.0, 90 mM MgCl2, 45 mM KCl, 1 mM NiSO4, 14% (w/v) PEG 5000 monomethyl ether