8QDQ
Vitis vinifera dimeric 13S-lipoxygenase LOXA in the closed conformation
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 | 2016-07-18 |
| Detector | DECTRIS PILATUS 6M-F |
| Wavelength(s) | 0.97625 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 85.767, 110.647, 91.173 |
| Unit cell angles | 90.00, 90.23, 90.00 |
Refinement procedure
| Resolution | 46.490 - 2.000 |
| R-factor | 0.2006 |
| Rwork | 0.199 |
| R-free | 0.23510 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.007 |
| RMSD bond angle | 0.854 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHENIX |
| Refinement software | PHENIX (1.19_4092) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.070 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rpim | 0.068 | |
| Number of reflections | 112946 | 11060 |
| <I/σ(I)> | 5.1 | |
| Completeness [%] | 98.4 | |
| Redundancy | 3.5 | |
| CC(1/2) | 0.993 | 0.769 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 291 | 0.1 M Tris pH 9.2, 26.4% PEG4000 |
