7MCL

Crystal structure of Staphylococcus aureus Cystathionine gamma-lyase, PLP bound

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS-II BEAMLINE 17-ID-2
Synchrotron site	NSLS-II
Beamline	17-ID-2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-10-03
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.91956
Spacegroup name	I 41 2 2
Unit cell lengths	104.966, 104.966, 289.569
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	19.960 - 2.400
R-factor	0.1834
Rwork	0.181
R-free	0.21440
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4ixz
RMSD bond length	0.008
RMSD bond angle	0.984
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX (1.14_3260)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	20.000	2.450
High resolution limit [Å]	2.400	2.400
Rmerge	0.194
Number of reflections	31961	1811
<I/σ(I)>	7
Completeness [%]	99.9	98.3
Redundancy	10.5	6.6
CC(1/2)	0.996	0.608

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.6	291	0.1 M Tris-HCl pH 7.6, 1.4 M Tri sodium Citrate