1F9C
CRYSTAL STRUCTURE OF MLE D178N VARIANT
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | EMBL/DESY, HAMBURG BEAMLINE X31 |
| Synchrotron site | EMBL/DESY, HAMBURG |
| Beamline | X31 |
| Temperature [K] | 103 |
| Detector technology | IMAGE PLATE |
| Collection date | 1998-09-01 |
| Detector | MARRESEARCH |
| Spacegroup name | I 4 |
| Unit cell lengths | 136.979, 136.979, 82.968 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 8.000 - 2.500 |
| R-factor | 0.18 * |
| Rwork | 0.187 |
| R-free | 0.23400 |
| RMSD bond length | 0.008 |
| RMSD bond angle | 26.100 * |
| 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 | |
| High resolution limit [Å] | 2.500 | 2.500 * |
| Rmerge | 0.046 | |
| Number of reflections | 22444 | |
| Completeness [%] | 87.0 | 59.3 * |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | MICRODIALYSIS | 6.5 | 277 | MES, NaCl, MnCl2, beta-mercaptoethanol, NaN3, pH 6.5, MICRODIALYSIS, temperature 277K |
