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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)



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

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