5A2G
An esterase from anaerobic Clostridium hathewayi can hydrolyze aliphatic aromatic polyesters
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PETRA III, DESY BEAMLINE P11 |
| Synchrotron site | PETRA III, DESY |
| Beamline | P11 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2014-03-10 |
| Detector | DECTRIS PILATUS 6M |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 62.050, 241.830, 83.580 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 60.103 - 1.899 |
| R-factor | 0.191 |
| Rwork | 0.189 |
| R-free | 0.23740 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2ogs |
| RMSD bond length | 0.005 |
| RMSD bond angle | 0.914 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | XDS |
| Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 60.000 | 2.000 |
| High resolution limit [Å] | 1.900 | 1.900 |
| Rmerge | 0.590 | |
| Number of reflections | 163181 | |
| <I/σ(I)> | 7.8 | 2.1 |
| Completeness [%] | 84.1 | 74.3 |
| Redundancy | 2.9 | 2.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 1.0 M AMMONIUM SULFATE, 0.1 M HEPES, PH 7.0 AND 0.5 % W/V POLYETHYLENE GLYCOL 8000 |
