9V6M
Insights into a Versatile PET-degrading Enzyme TmFae-PETase : From Molecular Mechanism to Practical Applications
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL18U1 |
| Synchrotron site | SSRF |
| Beamline | BL18U1 |
| Temperature [K] | 150 |
| Detector technology | PIXEL |
| Collection date | 2024-12-11 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 0.979 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 47.062, 111.972, 118.361 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 30.230 - 2.000 |
| R-factor | 0.2907 |
| Rwork | 0.288 |
| R-free | 0.33850 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.008 |
| RMSD bond angle | 0.966 |
| Data reduction software | xia2 |
| Data scaling software | xia2 |
| Phasing software | PHENIX |
| Refinement software | PHENIX (1.13_2998) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.230 | 2.030 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmerge | 0.126 | 1.039 |
| Number of reflections | 42844 | 2083 |
| <I/σ(I)> | 6.6 | |
| Completeness [%] | 99.3 | |
| Redundancy | 1.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 290 | 0.1 M MES monohydrate pH 6.5;12% w/v Polyethylene glycol 20,000 |
