Solution conformation of Monensin free acid,a typical representative of the polyetherin antibiotics

The solution conformation of the ionophore Monensin in its free-acid form bears a close resemblance to that of its Na⁺ salt. The backbone is folded into a closed loop, and the pseudocyclic structure is shut by head-to-tail H bonding between the carboxylic function and the alcoholic functions of the last six-membered ring with the mediation of a water molecule. A mode of trapping is proposed and compared to features observed in some other membrane-active complexones.