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Ligand · LUY

LUY · ~{N}-(2-phenylethyl)-1~{H}-benzimidazol-2-amine

LUY, ~{N}-(2-phenylethyl)-1~{H}-benzimidazol-2-amine (C15 H15 N3, 237.3 g/mol), in the MolNFT structures on GenesisL1: bound in 5 records (4 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and…

Component
LUY
Formula
C15 H15 N3
Class
ligand
Structures
5
PDB entries
4

Binding sites

LUY in 5 structures; the first of them:

  • 5SLN · PanDDA analysis group deposition -- Crystal Structure of SARS-CoV-2 NSP14 in complex with… · LUY D606 · binds HIS330, ILE332, TYR351, LEU366, PHE367, TYR370, CYS382
  • 5QPK · Pandda analysis group deposition -- crystal structure of T. cruzi fpps in complex with… · LUY A405 · binds TYR94, LEU95, MET101, THR163, ALA164, GLN167, LYS207, THR208 and 4 more
  • 5QR7 · Pandda analysis group deposition -- crystal structure of human ALAS2A in complex with… · LUY B602 · binds TRP171, ALA174, PHE177, ASP190
  • 5S2I · Pandda analysis group deposition -- crystal structure of SARS-cov-2 NSP3 macrodomain in… · LUY B601 · binds GLY133, ALA134, ASP135, PRO136, ASP157, ASN159, LEU160
  • 5SLN · Pandda analysis group deposition -- crystal structure of SARS-cov-2 NSP14 in complex with… · LUY D606 · binds HIS330, ILE332, TYR351, LEU366, PHE367, TYR370, CYS382

Residues it binds most

TYR 4, ASP 4, LEU 5, PHE 5, HIS 3, ALA 3, THR 2, CYS 2, GLN 1, ILE 2 (residue and the binding sites it lines).

Found with

  • ZN · Zinc ion
  • PO4 · Phosphate ion
  • PLP · Pyridoxal-5'-phosphate
  • SO4 · Sulfate ion
  • ACT · Acetate ion

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