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Publications

Abhijeet Kapoor, Gerard Martinez-Rosell, Davide Provasi, Gianni de Fabritiis & Marta Filizola. 2017. Dynamic and Kinetic Elements of µ-Opioid Receptor Functional Selectivity. Scientific reports 7 (1). doi: 10.1038/s41598-017-11483-8. (https://www.nature.com/articles/s41598-017-11483-8)


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
Mu-type opioid receptor oprm_mouse P42866 Opioid receptors A 5C1M Active Mus musculus Complex Morphine Active mu-opioid receptor bound to the agonist morphine 24317 POP CHL 1.20 ACEMD 5.0.6 CHARMM May 2015 Marta Filizola, Icahn School of Medicine at Mout Sinai Report
Mu-type opioid receptor oprm_mouse P42866 Opioid receptors A 5C1M Active Mus musculus Complex Oliceridine Mu-type opioid receptor bound to Oliceridine 24334 CHL1 POPC 1.18 ACEMD 5.0.6 CHARMM May 2015 Marta Filizola, Icahn School of Medicine at Mout Sinai Report

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