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Ligand · A1AON

A1AON · (2S)-1-(3,4-dichlorophenoxy)-3-(4-{[4-(trifluoromethyl)pyrimidin-2-yl]amino}piperidin-1-yl)propan-2-ol

A1AON, (2S)-1-(3,4-dichlorophenoxy)-3-(4-{[4-(trifluoromethyl)pyrimidin-2-yl]amino}piperidin-1-yl)propan-2-ol (C19 H21 Cl2 F3 N4 O2, 465.3 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every binding site…

Component
A1AON
Formula
C19 H21 Cl2 F3 N4 O2
Class
ligand
Structures
1
PDB entries
1

Binding sites

A1AON in 1 structure; the first of them:

  • 9BFM · Cryo-EM co-structure of AcrB with the EPM35 efflux pump inhibitor · A1AON A1101 · binds PHE136, VAL139, GLN151, GLN176, PHE178, GLY179, ILE277, ILE278 and 10 more

Residues it binds most

PHE 1, ALA 1, GLN 1, GLY 1, ILE 1, VAL 1, PRO 1, SER 1, TYR 1 (residue and the binding sites it lines).

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