8WKZ
Crystal structure of the Melanocortin-4 Receptor (MC4R) in complex with S31
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SPRING-8 BEAMLINE BL45XU |
| Synchrotron site | SPring-8 |
| Beamline | BL45XU |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2020-02-10 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 1.000 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 167.460, 44.940, 89.570 |
| Unit cell angles | 90.00, 97.60, 90.00 |
Refinement procedure
| Resolution | 44.390 - 3.300 |
| R-factor | 0.2159 |
| Rwork | 0.213 |
| R-free | 0.27180 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.002 |
| RMSD bond angle | 0.412 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHASER |
| Refinement software | PHENIX ((1.19.2_4158: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 44.460 | 3.420 |
| High resolution limit [Å] | 3.300 | 3.300 |
| Rmerge | 0.583 | 3.305 |
| Rmeas | 3.409 | |
| Rpim | 0.825 | |
| Number of reflections | 10306 | 1029 |
| <I/σ(I)> | 7.5 | 1.2 |
| Completeness [%] | 100.0 | |
| Redundancy | 16.46 | |
| CC(1/2) | 0.982 | 0.553 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | LIPIDIC CUBIC PHASE | 293 | PEG 400, Bis-tris propane buffer, CaCl2-2H2O |
