6HIU
Cytochrome P460 from Methylococcus capsulatus (Bath)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I04-1 |
| Synchrotron site | Diamond |
| Beamline | I04-1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2017-03-12 |
| Detector | DECTRIS PILATUS 6M-F |
| Wavelength(s) | 0.928 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 46.623, 81.647, 85.264 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 42.670 - 1.360 |
| R-factor | 0.1969 |
| Rwork | 0.197 |
| R-free | 0.22370 |
| Structure solution method | SAD |
| RMSD bond length | 0.021 |
| RMSD bond angle | 1.840 |
| Data reduction software | xia2 |
| Data scaling software | Aimless |
| Phasing software | Auto-Rickshaw |
| Refinement software | REFMAC (5.8.0230) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 46.620 | 1.380 |
| High resolution limit [Å] | 1.360 | 1.360 |
| Rmerge | 0.043 | 1.048 |
| Rmeas | 0.048 | 1.195 |
| Rpim | 0.020 | 0.562 |
| Number of reflections | 70585 | 3431 |
| <I/σ(I)> | 13.7 | 1.2 |
| Completeness [%] | 99.9 | 98.5 |
| Redundancy | 5.4 | 4.4 |
| CC(1/2) | 1.000 | 0.486 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 8 | 291 | 2microlitres of 15mg/ml protein in 20mM Tris buffer, pH8, with an equivalent volume of reservoir solution containing 0.1M Tris, 2.4M Ammonium sulfate pH8 |
