2BVJ
Ligand-free structure of cytochrome P450 PikC (CYP107L1)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 22-ID |
| Synchrotron site | APS |
| Beamline | 22-ID |
| Temperature [K] | 110 |
| Detector technology | CCD |
| Collection date | 2005-02-17 |
| Detector | MARRESEARCH |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 218.190, 64.171, 73.593 |
| Unit cell angles | 90.00, 107.15, 90.00 |
Refinement procedure
| Resolution | 36.980 - 2.100 |
| R-factor | 0.202 |
| Rwork | 0.202 |
| R-free | 0.24300 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1oxa |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.200 |
| Data reduction software | HKL-2000 |
| Data scaling software | SCALEPACK |
| Phasing software | CNS |
| Refinement software | CNS (1.1) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.180 |
| High resolution limit [Å] | 2.100 | 2.100 |
| Rmerge | 0.060 | 0.260 |
| Number of reflections | 55910 | |
| <I/σ(I)> | 19.5 | 3.7 |
| Completeness [%] | 98.2 | 87.6 |
| Redundancy | 3.7 | 3.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 7.5 | 10% PEG 8000; 0.1 M HEPES, PH 7.5; 0.5 MM DTT |
