5FYF
Structure of CYP153A from Marinobacter aquaeolei
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I03 |
| Synchrotron site | Diamond |
| Beamline | I03 |
| Temperature [K] | 120 |
| Detector technology | PIXEL |
| Collection date | 2014-12-07 |
| Detector | DECTRIS PIXEL |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 59.590, 71.110, 215.180 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 107.590 - 2.040 |
| R-factor | 0.20035 |
| Rwork | 0.198 |
| R-free | 0.23694 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3rwl |
| RMSD bond length | 0.017 |
| RMSD bond angle | 1.915 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0135) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 107.590 | 2.090 |
| High resolution limit [Å] | 2.040 | 2.040 |
| Rmerge | 0.060 | 0.650 |
| Number of reflections | 59290 | |
| <I/σ(I)> | 15.6 | 2.8 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 6.5 | 6.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 5.5 | PH 5.5 0.1 M BIS-TRIS PROPANE; 25% (W/V) PEG 3350; 30 MG PER ML PROTEIN |
