2Z5X
Crystal Structure of Human Monoamine Oxidase A with Harmine
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL44XU |
Synchrotron site | SPring-8 |
Beamline | BL44XU |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2006-11-16 |
Detector | Bruker DIP-6040 |
Wavelength(s) | 0.9 |
Spacegroup name | C 2 2 2 |
Unit cell lengths | 135.263, 218.706, 54.373 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 57.540 - 2.200 |
R-factor | 0.20408 |
Rwork | 0.201 |
R-free | 0.25531 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1o5w |
RMSD bond length | 0.023 |
RMSD bond angle | 2.125 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | MOLREP |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 60.280 | 2.320 |
High resolution limit [Å] | 2.200 | 2.200 |
Rmerge | 0.138 | 0.670 |
Number of reflections | 41775 | |
<I/σ(I)> | 6.7 | 1.6 |
Completeness [%] | 99.8 | 99.7 |
Redundancy | 4.9 | 4.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 5.6 | 277 | 1.6M AMMONIUM SULFATE, 100mM CITRIC ACID, pH 5.60, VAPOR DIFFUSION, SITTING DROP, temperature 277K |