6CM4
Structure of the D2 Dopamine Receptor Bound to the Atypical Antipsychotic Drug Risperidone
Replaces: 6C38Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 23-ID-B |
Synchrotron site | APS |
Beamline | 23-ID-B |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2017-08-13 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 1.033 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 50.979, 72.523, 151.307 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 29.549 - 2.867 |
R-factor | 0.2271 |
Rwork | 0.226 |
R-free | 0.24920 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | PDB entries 5WIU & 2RH1 |
RMSD bond length | 0.003 |
RMSD bond angle | 0.516 |
Data reduction software | HKL-3000 |
Data scaling software | HKL-3000 |
Phasing software | PHASER |
Refinement software | PHENIX ((1.12_2829: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 2.990 |
High resolution limit [Å] | 2.867 | 2.900 |
Rmerge | 0.134 | 0.738 |
Number of reflections | 12826 | 889 |
<I/σ(I)> | 15.2 | 1 |
Completeness [%] | 97.3 | 86.9 |
Redundancy | 5.5 | 2.5 |
CC(1/2) | 0.994 | 0.535 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | LIPIDIC CUBIC PHASE | 293 | 100 mM Tris-HCl, pH 7.8, 230 mM lithium nitrate, 25% PEG400, 4% 1,3-butanediol |