6GMF
Structure of Cytochrome P450 CYP109Q5 from Chondromyces apiculatus
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I04 |
| Synchrotron site | Diamond |
| Beamline | I04 |
| Temperature [K] | 120 |
| Detector technology | PIXEL |
| Collection date | 2017-12-17 |
| Detector | DECTRIS PILATUS 6M-F |
| Wavelength(s) | 0.97950 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 44.690, 55.020, 74.800 |
| Unit cell angles | 90.00, 91.67, 90.00 |
Refinement procedure
| Resolution | 44.710 - 1.550 |
| R-factor | 0.18669 |
| Rwork | 0.185 |
| R-free | 0.21950 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5ofq |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.589 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0222) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 55.020 | 1.580 |
| High resolution limit [Å] | 1.550 | 1.550 |
| Rmerge | 0.050 | 0.530 |
| Rpim | 0.040 | 0.450 |
| Number of reflections | 52220 | 2586 |
| <I/σ(I)> | 11.6 | 2 |
| Completeness [%] | 99.8 | 99.8 |
| Redundancy | 3.9 | 4 |
| CC(1/2) | 1.000 | 0.820 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 298 | 0.1 M Tris-HCl pH 8.5, 28% (w/v) PEG 3350, 0.1 M NaCl |
