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Publications

Marie-Lise Jobin, Véronique De Smedt-Peyrusse, Fabien Ducrocq, Rim Baccouch, Asma Oummadi, Maria Hauge Pedersen, Brian Medel-Lacruz, Maria-Florencia Angelo, Sandrine Villette, Pierre Van Delft, Laetitia Fouillen, Sébastien Mongrand, Jana Selent, Tarson Tolentino-Cortez, Gabriel Barreda-Gómez, Stéphane Grégoire, Elodie Masson, Thierry Durroux, Jonathan A. Javitch, Ramon Guixà-González, Isabel D. Alves, Pierre Trifilieff. 2023. Impact of membrane lipid polyunsaturation on dopamine D2 receptor ligand binding and signaling. Molecular Psychiatry. doi: 10.1038/s41380-022-01928-6.



Dynamic id Receptor Model name Uniprot entry name Uniprot ID Family Class PDB ID State Species Model type Source type Ligand(s) Num. of atoms Membrane composition Accum. sim. time (µs) Software Force field Submitted by
1239 D(2) dopamine receptor Dopamine D2 receptor drd2_human P14416 Dopamine receptors A 6CM4 Inactive Homo sapiens Apoform X-ray 43025 CHL1 OMEG DOPC PSM DSPC DPPC 4.00 ACEMD 3.3.0 CHARMM CHARMM36m Ramon Guixà-González, Paul Scherrer Institut
1240 D(2) dopamine receptor Dopamine d2 receptor (apoform) drd2_human P14416 Dopamine receptors A 6CM4 Inactive Homo sapiens Apoform X-ray 42931 CHL1 SDPC DOPC PSM DSPC DPPC 3.73 ACEMD 3.3.0 CHARMM CHARMM36m Ramon Guixà-González, Paul Scherrer Institut
1241 Guanine nucleotide-binding protein g(i)/g(s)/g(t) subunit beta-1 Dopamine D2 receptor in complex with aripiprazole drd2_human P62873 Dopamine receptors A 6VMS Active Homo sapiens Complex X-ray Aripiprazole 42983 CHL1 SDPC DOPC PSM DSPC DPPC 4.00 ACEMD 3.3.0 CHARMM CHARMM36m Ramon Guixà-González, Paul Scherrer Institut
1242 Guanine nucleotide-binding protein g(i)/g(s)/g(t) subunit beta-1 Dopamine D2 receptor in complex with dopamine drd2_human P62873 Dopamine receptors A 6VMS Active Homo sapiens Complex X-ray Dopamine 43136 CHL1 SDPC DOPC PSM DSPC DPPC 4.17 ACEMD 3.3.0 CHARMM CHARMM36m Ramon Guixà-González, Paul Scherrer Institut
1243 D(2) dopamine receptor Dopamine D2 receptor (apoform) drd2_human P14416 Dopamine receptors A 6CM4 Inactive Homo sapiens Apoform X-ray 42802 CHL1 SM18 SDPC DOPC DSPC DPPC 3.61 ACEMD 3.3.0 CHARMM CHARMM36m Ramon Guixà-González, Paul Scherrer Institut

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