Title : Human P2Y(6) receptor: molecular modeling leads to the rational design of a novel agonist based on a unique conformational preference.

Pub. Date : 2005 Dec 29

PMID : 16366591






1 Functional Relationships(s)
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1 Combining molecular dynamics (MD) in a hydrated phospholipid (DOPC) bilayer, a Monte Carlo search, and synthesis of locked nucleotide analogues, we discovered that the Southern conformation of the ribose is preferred for ligand recognition by the P2Y(6) receptor. Ribose pyrimidinergic receptor P2Y6 Homo sapiens