1W0E
Crystal structure of human cytochrome P450 3A4
Experimental procedure
| Experimental method | MAD |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID29 |
| Synchrotron site | ESRF |
| Beamline | ID29 |
| Temperature [K] | 100 |
| Collection date | 2002-09-11 |
| Wavelength(s) | 1.7398, 1.7406 |
| Spacegroup name | I 2 2 2 |
| Unit cell lengths | 77.940, 100.910, 131.000 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 200.000 - 2.800 |
| Rwork | 0.244 |
| R-free | 0.27380 |
| Structure solution method | MAD |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.900 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Refinement software | CNX (2002) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 80.000 | 2.950 |
| High resolution limit [Å] | 2.800 | 2.800 |
| Rmerge | 0.072 | 0.626 |
| Number of reflections | 12946 | |
| <I/σ(I)> | 6.7 | 1.2 |
| Completeness [%] | 95.6 | 74.5 |
| Redundancy | 6.4 | 4.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 7.5 | 0.1M HEPES PH 7.5, 0.025M NACL, 7.5% (V/V) ISOPROPANOL, 10 |
