3G5H
Crystallographic analysis of cytochrome P450 cyp121
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID23-2 |
| Synchrotron site | ESRF |
| Beamline | ID23-2 |
| Detector technology | CCD |
| Detector | ADSC QUANTUM Q315r |
| Wavelength(s) | 0.997 |
| Spacegroup name | P 65 2 2 |
| Unit cell lengths | 77.690, 77.690, 262.737 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 67.270 - 1.400 |
| R-factor | 0.15246 |
| Rwork | 0.151 |
| R-free | 0.18061 |
| Structure solution method | FOURIER SYNTHESIS |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.436 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | FFT |
| Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 1.480 | |
| High resolution limit [Å] | 1.400 | 1.400 |
| Rmerge | 0.069 | 0.620 |
| Number of reflections | 88013 | |
| <I/σ(I)> | 19.6 | 2.8 |
| Completeness [%] | 94.6 | 71.8 |
| Redundancy | 8.1 | 5.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 277 | Ammonium sulfate, pH 6.5, VAPOR DIFFUSION, SITTING DROP, temperature 277K |
