7SVX
Structure of EmrE-D3 mutant in complex with monobody L10 and harmane
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 21-ID-D |
| Synchrotron site | APS |
| Beamline | 21-ID-D |
| Temperature [K] | 80 |
| Detector technology | PIXEL |
| Collection date | 2021-09-21 |
| Detector | DECTRIS EIGER X 9M |
| Wavelength(s) | 0.9183 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 145.703, 51.837, 114.959 |
| Unit cell angles | 90.00, 92.68, 90.00 |
Refinement procedure
| Resolution | 60.210 - 3.900 |
| R-factor | 0.3407 |
| Rwork | 0.342 |
| R-free | 0.34360 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 6wk8 |
| Data reduction software | DIALS |
| Data scaling software | STARANISO |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.17.1_3660) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 114.830 | 4.650 |
| High resolution limit [Å] | 3.900 | 3.921 |
| Number of reflections | 3378 | 338 |
| <I/σ(I)> | 8.2 | |
| Completeness [%] | 82.1 | 69.6 |
| Redundancy | 6.6 | 6.7 |
| CC(1/2) | 0.991 | 0.921 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.1 | 294 | 0.1 M ammonium sulfate, 0.1 M HEPES, pH 7.1, 33.8% PEG600 |
