8J6N
Crystal structure of Cystathionine gamma-lyase in complex with compound 1
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SPRING-8 BEAMLINE BL44XU |
| Synchrotron site | SPring-8 |
| Beamline | BL44XU |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2016-02-27 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 0.9 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 176.214, 184.121, 175.944 |
| Unit cell angles | 90.00, 99.46, 90.00 |
Refinement procedure
| Resolution | 48.980 - 1.900 |
| R-factor | 0.17362 |
| Rwork | 0.172 |
| R-free | 0.19570 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.584 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.980 | 1.930 |
| High resolution limit [Å] | 1.900 | 1.900 |
| Number of reflections | 430998 | 20919 |
| <I/σ(I)> | 7.8 | |
| Completeness [%] | 99.4 | |
| Redundancy | 3.8 | |
| CC(1/2) | 0.994 | 0.729 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | 0.18 M tri-Ammonium citrate, 20% Polyethylene glycol 3,350 |
