5AIG
Discovery and characterization of thermophilic limonene-1,2-epoxide hydrolases from hot spring metagenomic libraries. Tomsk-sample- Valpromide complex
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I03 |
| Synchrotron site | Diamond |
| Beamline | I03 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Detector | DECTRIS PILATUS 6M |
| Spacegroup name | P 65 |
| Unit cell lengths | 96.460, 96.460, 56.940 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 48.230 - 1.160 |
| R-factor | 0.10923 |
| Rwork | 0.108 |
| R-free | 0.13265 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1nww |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.620 |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0073) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.200 | 1.190 |
| High resolution limit [Å] | 1.160 | 1.160 |
| Rmerge | 0.060 | 0.970 |
| Number of reflections | 104136 | |
| <I/σ(I)> | 15.9 | 2 |
| Completeness [%] | 99.9 | 99.4 |
| Redundancy | 9.7 | 7.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 |
