3MPH
The structure of human diamine oxidase complexed with an inhibitor aminoguanidine
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU RU200 |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2009-11-25 |
| Detector | MAR scanner 345 mm plate |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 92.685, 94.604, 196.051 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 31.130 - 2.050 |
| R-factor | 0.1794 |
| Rwork | 0.177 |
| R-free | 0.21486 |
| Structure solution method | BY REFINEMENT |
| Starting model (for MR) | 3hi7 |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.251 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA (3.2.25) |
| Phasing software | REFMAC (5.5.0088) |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 31.136 | 2.140 |
| High resolution limit [Å] | 2.037 | 2.030 |
| Rmerge | 0.135 | 0.490 |
| Total number of observations | 48133 | |
| Number of reflections | 106658 | |
| <I/σ(I)> | 10.2 | 2.6 |
| Completeness [%] | 95.6 | 77 |
| Redundancy | 4.3 | 3.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 298 | 0.1M bis-tris propane, 20%(w/v) PEG 3350, 0.2M sodium sulfate, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 298K |
