8R2T
Crystal structure of 4-hydroxybenzoate-1-hydroxylase from Gelatoporia subvermispora (GsMNX1)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I03 |
| Synchrotron site | Diamond |
| Beamline | I03 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2023-03-17 |
| Detector | DECTRIS EIGER2 XE 16M |
| Wavelength(s) | 0.9763 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 112.216, 64.789, 160.100 |
| Unit cell angles | 90.00, 93.90, 90.00 |
Refinement procedure
| Resolution | 159.730 - 1.824 |
| Rwork | 0.179 |
| R-free | 0.22460 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.555 |
| Data reduction software | autoPROC |
| Data scaling software | STARANISO |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0405) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 159.730 | 2.108 |
| High resolution limit [Å] | 1.824 | 1.824 |
| Rmerge | 0.184 | 1.016 |
| Rpim | 0.075 | 0.434 |
| Number of reflections | 57625 | 2881 |
| <I/σ(I)> | 6.5 | 1.7 |
| Completeness [%] | 92.7 | 58.9 |
| Redundancy | 7.1 | 6.3 |
| CC(1/2) | 0.994 | 0.786 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | LMB screen from Molecular Dimensions condition G7 (11% PEG 8000, 0.4 M sodium chloride, 0.1 M sodium cacodylate pH 6.2) |
