6BQH
Crystal structure of 5-HT2C in complex with ritanserin
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SPRING-8 BEAMLINE BL41XU |
| Synchrotron site | SPring-8 |
| Beamline | BL41XU |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2016-11-08 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 1.000 |
| Spacegroup name | C 2 2 2 |
| Unit cell lengths | 88.310, 97.050, 150.230 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 48.525 - 2.700 |
| R-factor | 0.2542 |
| Rwork | 0.253 |
| R-free | 0.27450 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4ib4 |
| RMSD bond length | 0.003 |
| RMSD bond angle | 0.600 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | PHENIX ((dev_2289: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.800 |
| High resolution limit [Å] | 2.700 | 2.700 |
| Rmerge | 0.080 | |
| Number of reflections | 17076 | 1578 |
| <I/σ(I)> | 14.3 | |
| Completeness [%] | 94.2 | 90.2 |
| Redundancy | 10.5 | 5.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | LIPIDIC CUBIC PHASE | 293 | 0.1 M sodium citrate pH 6.0, 100mM (NH4)2SO4, 30% PEG400 |
