8B9M

Cysteine Synthase from Leishmania Infantum

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I24
Synchrotron site	Diamond
Beamline	I24
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-07-19
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.987
Spacegroup name	P 21 21 21
Unit cell lengths	48.879, 87.759, 138.073
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	74.175 - 1.750
Rwork	0.164
R-free	0.20520
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4air
RMSD bond length	0.008
RMSD bond angle	1.475
Data reduction software	xia2
Data scaling software	xia2
Phasing software	PHASER
Refinement software	REFMAC (5.8.0352)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	87.770	1.780
High resolution limit [Å]	1.750	1.750
Number of reflections	60590	2908
<I/σ(I)>	11.96
Completeness [%]	99.6
Redundancy	11.8
CC(1/2)	0.991	0.805

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		277	Sodium Chloride, Bis-Tris, PEG 3350