4BE4
Closed conformation of O. piceae sterol esterase
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 |
| Detector | DECTRIS PILATUS 6M |
| Spacegroup name | P 63 2 2 |
| Unit cell lengths | 119.274, 119.274, 206.774 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 46.228 - 2.600 |
| R-factor | 0.1669 |
| Rwork | 0.164 |
| R-free | 0.22070 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.078 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 46.230 | 2.740 |
| High resolution limit [Å] | 2.600 | 2.600 |
| Rmerge | 0.150 | 0.820 |
| Number of reflections | 26901 | |
| <I/σ(I)> | 6.9 | 1.9 |
| Completeness [%] | 98.5 | 98.2 |
| Redundancy | 3.4 | 3.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 6.5 | 10% 1,4-DIOXANE, 0.1 M MES PH 6.5, 1.6 M AMMONIUM SULFATE |
