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 |