8BIS

Crystal structure of cystathionine gamma-lyase from Toxoplasma gondii in complex with DL-propargylglycine

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALBA BEAMLINE XALOC
Synchrotron site	ALBA
Beamline	XALOC
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-04-10
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.9791
Spacegroup name	P 3 2 1
Unit cell lengths	157.452, 157.452, 93.199
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	45.452 - 2.266
R-factor	0.1658
Rwork	0.162
R-free	0.18600
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2nmp
RMSD bond length	0.003
RMSD bond angle	0.680
Phasing software	PHASER
Refinement software	PHENIX (1.18)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	45.452	2.310
High resolution limit [Å]	2.260	2.260
Number of reflections	61247	2656
<I/σ(I)>	14.2
Completeness [%]	98.8
Redundancy	26.8
CC(1/2)	0.995	0.641

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		291	12% (w/v) PEG 3350, 0.1 M sodium citrate pH 4.6, CYMAL-4