3ZDN
D11-C mutant of monoamine oxidase from Aspergillus niger
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I04 |
| Synchrotron site | Diamond |
| Beamline | I04 |
| Temperature [K] | 120 |
| Detector technology | CCD |
| Collection date | 2011-09-22 |
| Detector | ADSC QUANTUM 315 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 108.600, 119.340, 178.780 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 99.260 - 2.550 |
| R-factor | 0.15576 |
| Rwork | 0.153 |
| R-free | 0.21428 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2vvm |
| RMSD bond length | 0.015 |
| RMSD bond angle | 1.766 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.7.0032) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 99.260 | 2.630 |
| High resolution limit [Å] | 2.550 | 2.550 |
| Rmerge | 0.120 | 0.480 |
| Number of reflections | 96920 | |
| <I/σ(I)> | 12 | 4.6 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 7.3 | 7.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 7 | 22% (W/V) PEG3350, 0.2M NA2SO4, 0.1M BIS-TRIS PROPANE AT PH 7.0 AND 200 MM PROLINE. |
