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Publications

Peters, Brandon L. and Deng, Jinxia and Ferguson, Andrew L., Garriga, Pere. 2020. Free energy calculations of the functional selectivity of 5-HT2B G protein-coupled receptor. PLOS ONE 15 (12). doi: 10.1371/journal.pone.0243313. (https://journals.plos.org/plosone/article?id=10.1371/journal.pone.0243313)


Receptor Uniprot entry name Uniprot ID Family Class PDB ID State Species Model type Ligand(s) Model name Num. of atoms Membrane composition Accum. sim. time (µs) Software Force field Submitted by
5-hydroxytryptamine receptor 2b 5ht2b_human P41595 5-Hydroxytryptamine receptors A 5TVN Intermediate Homo sapiens Apoform 5-HT2B receptor 124986 POP 0.10 GROMACS v2018.3 Gromos 54a7 GPCRmd community Report
5-hydroxytryptamine receptor 2b 5ht2b_human P41595 5-Hydroxytryptamine receptors A 5TVN Intermediate Homo sapiens Apoform name 5-HT2B receptor 124956 POP 0.10 GROMACS v2018.3 Gromos 54a7 GPCRmd community Report
5-hydroxytryptamine receptor 2b 5ht2b_human P41595 5-Hydroxytryptamine receptors A 5TVN Intermediate Homo sapiens Complex Lysergide 5-HT2B receptor in complex with Lysergide 205200 POP 0.10 GROMACS v2018.3 Gromos 54a7 GPCRmd community Report
5-hydroxytryptamine receptor 2b 5ht2b_human P41595 5-Hydroxytryptamine receptors A 5TVN Intermediate Homo sapiens Apoform 5-HT2B receptor 124986 POP 0.10 GROMACS v2018.3 Gromos 54a7 GPCRmd community Report

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