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Ligand · KHA

KHA · 1-(4-{[(2-hydroxyethyl)amino]carbonyl}benzyl)-1-methylpiperidinium

KHA, 1-(4-{[(2-hydroxyethyl)amino]carbonyl}benzyl)-1-methylpiperidinium (C16 H25 N2 O2 +1, 277.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å, the…

Component
KHA
Formula
C16 H25 N2 O2 +1
Class
ligand
Structures
2
PDB entries
1

Binding sites

KHA in 2 structures; the first of them:

  • 1UWG · Molecular Mechanism of Enantioselective Proton Transfer to Carbon in Catalytic Antibody… · KHA H1215 · binds ASN33, TYR35, TRP47, GLY49, GLY50, ILE51, ASP52, VAL58 and 10 more
  • 1UWG · Molecular mechanism of enantioselective proton transfer to carbon in catalytic antibody… · KHA H1215 · binds ASN33, TYR35, TRP47, GLY49, GLY50, ILE51, ASP52, VAL58 and 10 more

Residues it binds most

TYR 4, GLY 4, ASP 4, PHE 4, ASN 4, VAL 4, ALA 4, GLN 4, ILE 4, TRP 4 (residue and the binding sites it lines).

Found with

  • PO4 · Phosphate ion

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