3USK
Crystal structure of LeuT bound to L-leucine in space group P21 from lipid bicelles
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALS BEAMLINE 8.2.1 |
| Synchrotron site | ALS |
| Beamline | 8.2.1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2011-09-10 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.9700 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 70.160, 112.483, 165.320 |
| Unit cell angles | 90.00, 97.57, 90.00 |
Refinement procedure
| Resolution | 19.905 - 4.500 |
| R-factor | 0.2654 |
| Rwork | 0.265 |
| R-free | 0.27070 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2a65 |
| RMSD bond length | 0.008 |
| RMSD bond angle | 0.518 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | PHENIX ((phenix.refine: 1.7_650)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 20.000 | 4.660 |
| High resolution limit [Å] | 4.500 | 4.500 |
| Rmerge | 0.116 | 0.180 |
| Number of reflections | 12873 | |
| <I/σ(I)> | 4.55 | 4.2 |
| Completeness [%] | 84.0 | 80.2 |
| Redundancy | 2.1 | 2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 4.7 | 293 | 100mM NaAc, 36% MPD, 10% PEG400, 50 mM MgCl2, pH 4.7, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
