9RKG
Mixed model refinement of beta-2 Adrenergic receptor with photoazolol in dark state and Light state, 10 seconds after light activation, 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 | 53.750 - 2.450 |
| Rwork | 0.183 |
| R-free | 0.21690 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Data reduction software | CrystFEL |
| Data scaling software | CrystFEL |
| Refinement software | PHENIX ((1.20_4459)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 53.750 | 2.540 |
| High resolution limit [Å] | 2.450 | 2.450 |
| Number of reflections | 27481 | 2741 |
| <I/σ(I)> | 8.27 | 0.74 |
| Completeness [%] | 100.0 | |
| Redundancy | 467 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | LIPIDIC CUBIC PHASE | 289 | 100 mM tri-sodium citrate (pH= 6.2), 245 mM Li2SO4, 32% PEG 350 MME, 10 uM photoazolol-1 |
