2V5Z
Structure of human MAO B in complex with the selective inhibitor safinamide
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID14-2 |
Synchrotron site | ESRF |
Beamline | ID14-2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2007-07-12 |
Detector | ADSC CCD |
Spacegroup name | C 2 2 2 |
Unit cell lengths | 132.551, 223.602, 86.589 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 15.000 - 1.600 |
R-factor | 0.20825 |
Rwork | 0.208 |
R-free | 0.22721 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1oj9 |
RMSD bond length | 0.007 |
RMSD bond angle | 1.059 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 1.640 |
High resolution limit [Å] | 1.600 | 1.600 |
Rmerge | 0.080 | |
Number of reflections | 164454 | 11773 |
<I/σ(I)> | 1.5 | |
Completeness [%] | 97.9 | |
Redundancy | 3.1 | 2.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 |