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EMD-24378
5-HT2AR bound to a novel agonist in complex with a mini-Gq protein and an active-state stabilizing single-chain variable fragment (scFv16) obtained by cryo-electron microscopy (cryoEM)
EMD-24378
Single-particle3.45 Å
Deposition: 02/07/2021Map released: 06/07/2022
Last modified: 21/05/2025
Sample Organism:
Homo sapiens
Sample: 5-HT2AR bound to a tetrahydropyridine agonist (R-69) in complex with heterotrimeric mini-Gq protein and single-chain variable fragment (scFv16)
Fitted models: 7ran
Deposition Authors: Barros-Alvarez X, Kim K, Panova O
Sample: 5-HT2AR bound to a tetrahydropyridine agonist (R-69) in complex with heterotrimeric mini-Gq protein and single-chain variable fragment (scFv16)
Fitted models: 7ran
Deposition Authors: Barros-Alvarez X, Kim K, Panova O
Bespoke library docking for 5-HT 2A receptor agonists with antidepressant activity.
Kaplan AL,
Confair DN,
Kim K,
Barros-Alvarez X,
Rodriguiz RM,
Yang Y,
Kweon OS,
Che T ,
McCorvy JD ,
Kamber DN,
Phelan JP ,
Martins LC ,
Pogorelov VM,
DiBerto JF,
Slocum ST,
Huang XP,
Kumar JM,
Robertson MJ ,
Panova O ,
Seven AB,
Wetsel AQ,
Wetsel WC ,
Irwin JJ ,
Skiniotis G ,
Shoichet BK ,
Roth BL ,
Ellman JA
(2022) Nature , 610 , 582 - 591
,
McCorvy JD ,
Kamber DN,
Phelan JP ,
Martins LC ,
Pogorelov VM,
DiBerto JF,
Slocum ST,
Huang XP,
Kumar JM,
Robertson MJ ,
Panova O ,
Seven AB,
Wetsel AQ,
Wetsel WC ,
Irwin JJ ,
Skiniotis G ,
Shoichet BK ,
Roth BL ,
Ellman JA
(2022) Nature , 610 , 582 - 591
Grant Support:
- Defense Advanced Research Projects Agency (DARPA): (United States)