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Ligand · A1A4B

A1A4B · [(2R)-2-methylpiperidin-1-yl](4-methyl-1,3-thiazol-5-yl)methanone

A1A4B, [(2R)-2-methylpiperidin-1-yl](4-methyl-1,3-thiazol-5-yl)methanone (C11 H16 N2 O S, 224.3 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every binding site with its residues within 4.5 Å, the residues…

Component
A1A4B
Formula
C11 H16 N2 O S
Class
ligand
Structures
1
PDB entries
1

Binding sites

A1A4B in 1 structure; the first of them:

  • 7HGG · PanDDA analysis group deposition -- Crystal structure of HRP-2 PWWP domain in complex… · A1A4B B103 · binds ASP30, GLY31, MET15, TYR18, TRP21, PHE44, THR47, GLU49 and 2 more

Residues it binds most

THR 1, ALA 1, ASP 1, GLU 1, GLY 1, MET 1, PHE 1, TRP 1, TYR 1 (residue and the binding sites it lines).

Found with

  • SO4 · Sulfate ion
  • EDO · 1,2-ethanediol

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