7OTS
Crystal structure of human Monoacylglycerol Lipase ABHD6 in complex with oleic acid and octyl glucoside
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SOLEIL BEAMLINE PROXIMA 1 |
| Synchrotron site | SOLEIL |
| Beamline | PROXIMA 1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2019-07-24 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 0.97856 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 60.815, 71.494, 77.830 |
| Unit cell angles | 90.00, 111.11, 90.00 |
Refinement procedure
| Resolution | 72.610 - 1.792 |
| R-factor | 0.2243 |
| Rwork | 0.222 |
| R-free | 0.26610 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4opm |
| RMSD bond length | 0.009 |
| RMSD bond angle | 0.980 |
| Data reduction software | autoPROC |
| Data scaling software | autoPROC |
| Phasing software | PHASER |
| Refinement software | BUSTER (2.11.8) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 72.600 | 1.930 |
| High resolution limit [Å] | 1.766 | 1.776 |
| Rmerge | 0.923 | |
| Rmeas | 1.000 | |
| Rpim | 0.540 | |
| Number of reflections | 41378 | 2071 |
| <I/σ(I)> | 5.3 | |
| Completeness [%] | 91.7 | 47.7 |
| Redundancy | 4.8 | |
| CC(1/2) | 0.985 | 0.457 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 295 | 0.2 M Lithium sulfate, 35 % PEG 3350, 0.1 M MES pH 6.5, 0.5% beta-OG |
