5HIW
Sorangium cellulosum So Ce56 cytochrome P450 260B1
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-4 |
| Synchrotron site | ESRF |
| Beamline | ID14-4 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2012-05-17 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.9393 |
| Spacegroup name | P 31 2 1 |
| Unit cell lengths | 60.420, 60.420, 190.820 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 35.300 - 1.850 |
| R-factor | 0.17467 |
| Rwork | 0.172 |
| R-free | 0.21876 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2vz7 |
| RMSD bond length | 0.020 |
| RMSD bond angle | 2.000 |
| Data reduction software | iMOSFLM |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0073) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 35.300 | 1.950 |
| High resolution limit [Å] | 1.850 | 1.850 |
| Rmerge | 0.060 | 0.270 |
| Number of reflections | 35292 | |
| <I/σ(I)> | 8.68 | 3.77 |
| Completeness [%] | 99.4 | 100 |
| Redundancy | 5.58 | 5.77 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.6 | 291 | PEG 8000, ammonium sulfate, cacodylate |
