Ligand · A1T

A1T · 5-pentyl-N-{[4'-(piperidin-1-ylcarbonyl)biphenyl-4-yl]methyl}-N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]pyridine-2-carboxamide

A1T, 5-pentyl-N-{[4'-(piperidin-1-ylcarbonyl)biphenyl-4-yl]methyl}-N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]pyridine-2-carboxamide (C41 H49 N5 O2, 643.9 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every…

Component: A1T
Formula: C41 H49 N5 O2
Class: ligand
Structures: 2
PDB entries: 1

Binding sites

A1T in 2 structures; the first of them:

2IGX · Achiral, Cheap and Potent Inhibitors of Plasmepsins II · A1T A330 · binds PHE11, ILE14, MET15, TYR17, ILE32, ASP34, GLY36, SER37 and 23 more
2IGX · Achiral, cheap and potent inhibitors of plasmepsins II · A1T A330 · binds PHE11, ILE14, MET15, TYR17, ILE32, ASP34, GLY36, SER37 and 23 more

Residues it binds most

ILE 2, PHE 2, TYR 2, ASP 2, GLY 2, THR 2, MET 2, SER 2, VAL 2, ALA 2 (residue and the binding sites it lines).

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