4RYX
Crystal structure of RPE65 in complex with emixustat and palmitate, P6522 crystal form
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 24-ID-C |
| Synchrotron site | APS |
| Beamline | 24-ID-C |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2014-03-24 |
| Detector | DECTRIS PILATUS 6M-F |
| Wavelength(s) | 0.97920 |
| Spacegroup name | P 65 2 2 |
| Unit cell lengths | 177.766, 177.766, 86.580 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 44.150 - 2.000 |
| R-factor | 0.16672 |
| Rwork | 0.164 |
| R-free | 0.20990 |
| Structure solution method | rigid body refinement |
| Starting model (for MR) | 4f3a |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.515 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | REFMAC |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.130 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmerge | 0.080 | 0.123 |
| Number of reflections | 53110 | |
| <I/σ(I)> | 10.3 | 0.97 |
| Completeness [%] | 97.7 | 98 |
| Redundancy | 3.3 | 3.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 281 | 35% MPD, 200 mM (NH4)2SO4 and 100 mM Tris, pH 8.5, VAPOR DIFFUSION, HANGING DROP, temperature 281K |
