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Ligand · A1H7A

A1H7A · (2-methyl-1,3-thiazol-5-yl)methyl (2S)-1-[(2S)-2-cyclohexyl-2-(3,4,5-trimethoxyphenyl)ethanoyl]piperidine-2-carboxylate

A1H7A, (2-methyl-1,3-thiazol-5-yl)methyl (2S)-1-[(2S)-2-cyclohexyl-2-(3,4,5-trimethoxyphenyl)ethanoyl]piperidine-2-carboxylate (C28 H38 N2 O6 S, 530.7 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every…

Component
A1H7A
Formula
C28 H38 N2 O6 S
Class
ligand
Structures
1
PDB entries
1

Binding sites

A1H7A in 1 structure; the first of them:

  • 9EU7 · The FK1 domain of FKBP51 in complex with SAFit-analog 15b · A1H7A A201 · binds TYR57, GLY59, LYS60, LEU61, LYS66, PHE67, ASP68, ARG73 and 12 more

Residues it binds most

PHE 2, LYS 2, ILE 2, LEU 2, TYR 2, GLY 2, VAL 2, ASP 2, TRP 2, ARG 1 (residue and the binding sites it lines).

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