8BK6
A truncated structure of LpMIP with bound inhibitor JK095.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID23-1 |
| Synchrotron site | ESRF |
| Beamline | ID23-1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2022-06-15 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.9763 |
| Spacegroup name | P 43 21 2 |
| Unit cell lengths | 73.557, 73.557, 103.286 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 59.920 - 2.263 |
| R-factor | 0.2868 |
| Rwork | 0.287 |
| R-free | 0.34820 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1fd9 |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.797 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX ((1.20.1_4487: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 59.920 | 5.500 |
| High resolution limit [Å] | 2.263 | 2.263 |
| Rmeas | 0.060 | 0.090 |
| Number of reflections | 13801 | 1334 |
| <I/σ(I)> | 8 | |
| Completeness [%] | 99.6 | |
| Redundancy | 7.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 298 | 20 %(v/v) 2-propanol, 0.2 M sodium citrate tribasic dihydrate, 0.1 M HEPES, pH 7.5 |
