1EK2
CRYSTAL STRUCTURE OF MURINE SOLUBLE EPOXIDE HYDROLASE COMPLEXED WITH CDU INHIBITOR
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | CHESS BEAMLINE A1 |
| Synchrotron site | CHESS |
| Beamline | A1 |
| Temperature [K] | 200 |
| Detector technology | CCD |
| Collection date | 1998-08-30 |
| Detector | OTHER |
| Spacegroup name | P 21 21 2 |
| Unit cell lengths | 151.900, 143.000, 60.000 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 20.000 - 3.000 |
| Rwork | 0.211 |
| R-free | 0.29000 |
| RMSD bond length | 0.007 |
| RMSD bond angle | 27.300 * |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | X-PLOR |
| Refinement software | X-PLOR (3.851) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 20.000 | 20.000 |
| High resolution limit [Å] | 3.000 | 3.000 |
| Rmerge | 0.069 | 0.282 |
| Total number of observations | 46217 * | |
| Number of reflections | 19689 * | |
| <I/σ(I)> | 10.5 | |
| Completeness [%] | 79.4 | 58.5 |
| Redundancy | 2.34 | 2.26 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6 | 298 | Argiriadi, M.A., (1999) Proc.Nat.Acad.Sci.USA, 96, 10637. * |
Crystallization Reagents in Literatures
| ID | crystal ID | solution | reagent name | concentration (unit) | details |
| 1 | 1 | drop | protein | 16 (mg/ml) | |
| 2 | 1 | drop | dithiothreitol | 3 (mM) | |
| 3 | 1 | drop | sodium phosphate | 100 (mM) | |
| 4 | 1 | drop | ammonium sulfate | 1.6 (M) | precipitant |
| 5 | 1 | drop | MES | 100 (mM) | precipitant |
| 6 | 1 | drop | ethanol | 1.4 (%(v/v)) | |
| 7 | 1 | reservoir | ammonium sulfate | 1.6 (M) | |
| 8 | 1 | reservoir | MES | 100 (mM) |
