2XVJ
Crystal structure of the mutant bacterial flavin containing monooxygenase in complex with indole
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PAL/PLS BEAMLINE 6B |
| Synchrotron site | PAL/PLS |
| Beamline | 6B |
| Temperature [K] | 294 |
| Detector technology | CCD |
| Collection date | 2010-01-13 |
| Detector | ADSC CCD |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 159.117, 67.850, 138.899 |
| Unit cell angles | 90.00, 90.62, 90.00 |
Refinement procedure
| Resolution | 50.010 - 2.480 |
| R-factor | 0.20083 |
| Rwork | 0.199 |
| R-free | 0.23682 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | NONE |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.040 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.5.0088) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.540 |
| High resolution limit [Å] | 2.500 | 2.500 |
| Rmerge | 0.080 | 0.330 |
| Number of reflections | 50468 | |
| <I/σ(I)> | 17.9 | 2.64 |
| Completeness [%] | 98.1 | 95 |
| Redundancy | 3.4 | 3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 15% PEG 3350 0.1 M MES PH 6.0 0.2 M AMMONIUM NITRATE |
