7K89
Crystal structure of bovine RPE65 in complex with 4-fluoro-emixustat and palmitate
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRL BEAMLINE BL12-2 |
| Synchrotron site | SSRL |
| Beamline | BL12-2 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2020-06-20 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.979460 |
| Spacegroup name | P 65 |
| Unit cell lengths | 175.695, 175.695, 86.214 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 47.840 - 2.150 |
| R-factor | 0.19039 |
| Rwork | 0.189 |
| R-free | 0.21718 |
| Structure solution method | FOURIER SYNTHESIS |
| Starting model (for MR) | 4rse |
| RMSD bond length | 0.002 |
| RMSD bond angle | 1.174 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | REFMAC |
| Refinement software | REFMAC (5.8.0266) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.280 |
| High resolution limit [Å] | 2.150 | 2.150 |
| Rmerge | 0.166 | 1.770 |
| Number of reflections | 82432 | 13267 |
| <I/σ(I)> | 9.8 | |
| Completeness [%] | 99.9 | |
| Redundancy | 6.8 | |
| CC(1/2) | 0.996 | 0.408 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 281.15 | Same as for entry 4RSE |
