6SBN
Polyester hydrolase PE-H of Pseudomonas aestusnigri
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID29 |
| Synchrotron site | ESRF |
| Beamline | ID29 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2018-09-02 |
| Detector | DECTRIS PILATUS 6M-F |
| Wavelength(s) | 0.976247 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 68.814, 80.014, 88.912 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 45.000 - 1.090 |
| R-factor | 0.1075 |
| Rwork | 0.107 |
| R-free | 0.13700 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.027 |
| RMSD bond angle | 2.206 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0131) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.160 |
| High resolution limit [Å] | 1.090 | 1.090 |
| Number of reflections | 101774 | 16134 |
| <I/σ(I)> | 16.2 | 4.7 |
| Completeness [%] | 99.5 | 98.4 |
| Redundancy | 12.7 | 12.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 285 | 0.1 M sodium acetate pH 4.5, 16 % (w/v) PEG 3000, 0.036 mM lyso-Foscholine14 |
