9J0H
The crystal structure of styrene monooxygenase StyA from Streptomyces vilmorinianum
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL19U1 |
| Synchrotron site | SSRF |
| Beamline | BL19U1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2023-11-26 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.979 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 88.506, 112.147, 345.324 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 48.250 - 2.860 |
| R-factor | 0.2127 |
| Rwork | 0.211 |
| R-free | 0.25340 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.003 |
| RMSD bond angle | 0.665 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 49.330 | 2.920 |
| High resolution limit [Å] | 2.860 | 2.860 |
| Rmerge | 0.119 | 0.781 |
| Number of reflections | 80084 | 4466 |
| <I/σ(I)> | 11.7 | 2.1 |
| Completeness [%] | 99.7 | 99.3 |
| Redundancy | 4.2 | 4.3 |
| CC(1/2) | 0.994 | 0.687 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 289.15 | 0.1 M Sodium citrate pH 6.0, 16% w/v PEG 4000 |
