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 |