7ZCL
Unspecific peroxygenase from Collariella virescens
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALBA BEAMLINE XALOC |
| Synchrotron site | ALBA |
| Beamline | XALOC |
| Temperature [K] | 110 |
| Detector technology | PIXEL |
| Collection date | 2020-10-04 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.97924 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 78.476, 140.131, 42.227 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 68.470 - 1.950 |
| R-factor | 0.1903 |
| Rwork | 0.188 |
| R-free | 0.24170 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2yor |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.032 |
| 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] | 70.100 | 2.060 |
| High resolution limit [Å] | 1.950 | 1.950 |
| Rmeas | 0.191 | 0.990 |
| Rpim | 0.057 | 0.400 |
| Number of reflections | 35859 | 5682 |
| <I/σ(I)> | 10.1 | 2.4 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 8.7 | 8.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 293 | 30% PEG 400, 0.1 M Tris, pH 8.5, 0.2 M sodium citrate |
