4XNX
X-ray structure of Drosophila dopamine transporter in complex with reboxetine
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 24-ID-C |
| Synchrotron site | APS |
| Beamline | 24-ID-C |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2013-03-15 |
| Detector | PSI PILATUS 6M |
| Wavelength(s) | 0.979 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 97.673, 141.036, 167.247 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 48.420 - 3.000 |
| R-factor | 0.219 |
| Rwork | 0.217 |
| R-free | 0.25800 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4m48 |
| RMSD bond length | 0.005 |
| RMSD bond angle | 0.908 |
| Data reduction software | HKL-2000 |
| Data scaling software | SCALEPACK |
| Phasing software | PHASER |
| Refinement software | PHENIX |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.417 | 3.110 |
| High resolution limit [Å] | 2.997 | 3.000 |
| Rmerge | 0.110 | 0.866 |
| Number of reflections | 46863 | |
| <I/σ(I)> | 5.6 | |
| Completeness [%] | 99.4 | 99.7 |
| Redundancy | 14.4 | 14 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 277 | PEG 350 MME 38%, Glycine 0.1M |
