5MTF
A modular route to novel potent and selective inhibitors of rhomboid intramembrane proteases
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | BESSY BEAMLINE 14.1 |
| Synchrotron site | BESSY |
| Beamline | 14.1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2016-04-20 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.918408 |
| Spacegroup name | H 3 2 |
| Unit cell lengths | 111.365, 111.365, 124.539 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 44.970 - 1.790 |
| R-factor | 0.169 |
| Rwork | 0.167 |
| R-free | 0.19200 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4qnz |
| Data reduction software | XDS |
| Phasing software | MOLREP |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 44.970 | 1.900 |
| High resolution limit [Å] | 1.787 | 1.790 |
| Number of reflections | 28202 | |
| <I/σ(I)> | 18.64 | 1.86 |
| Completeness [%] | 99.8 | 99.6 |
| Redundancy | 5 | 4.95 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 298 | 3M NH4Cl, 25mM Bis Tris pH7 |
