9RKF
Dark structure of beta-2 Adrenergic receptor with photoazolol in Dark state recorded at SwissFEL
This is a non-PDB format compatible entry.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | FREE ELECTRON LASER |
| Source details | SwissFEL ARAMIS BEAMLINE ESC |
| Synchrotron site | SwissFEL ARAMIS |
| Beamline | ESC |
| Temperature [K] | 293 |
| Detector technology | PIXEL |
| Collection date | 2024-02-20 |
| Detector | PSI JUNGFRAU 8M |
| Wavelength(s) | 1.0294 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 111.940, 172.230, 41.230 |
| Unit cell angles | 90.00, 106.20, 90.00 |
Refinement procedure
| Resolution | 45.600 - 2.450 |
| R-factor | 0.1842 |
| Rwork | 0.181 |
| R-free | 0.21860 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.009 |
| RMSD bond angle | 0.690 |
| Data reduction software | CrystFEL |
| Data scaling software | CrystFEL |
| Phasing software | PHENIX |
| Refinement software | PHENIX ((1.20_4459)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 45.600 | 2.540 |
| High resolution limit [Å] | 2.450 | 2.450 |
| Number of reflections | 25868 | 2741 |
| <I/σ(I)> | 8.4 | 0.75 |
| Completeness [%] | 99.8 | |
| Redundancy | 153 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | LIPIDIC CUBIC PHASE | 289 | 100mM tri-sodium citrate pH= 6.2, 245mM Li2SO4, 32% PEG 350 MME, 10uM photoazolol-1 |
