5ENS
Rhodamine bound structure of bacterial efflux pump.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06DA |
| Synchrotron site | SLS |
| Beamline | X06DA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2015-05-08 |
| Detector | DECTRIS PILATUS 2M |
| Wavelength(s) | 1.0 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 108.652, 145.245, 174.148 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 50.000 - 2.800 |
| R-factor | 0.19723 |
| Rwork | 0.194 |
| R-free | 0.25803 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5en5 |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.493 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0135) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.970 |
| High resolution limit [Å] | 2.800 | 2.800 |
| Rmerge | 0.285 | 1.273 |
| Number of reflections | 68419 | |
| <I/σ(I)> | 5.16 | |
| Completeness [%] | 99.7 | 98.9 |
| Redundancy | 6.7 | 6.6 |
| CC(1/2) | 0.958 | 0.419 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 291 | 0.1 MES pH6.5, 0.21M NaCl, 11.5% PEG4000 |
