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Ligand · 8PC

8PC · 2-(2,4-dichlorophenoxy)-5-(pyridin-2-ylmethyl)phenol

8PC, 2-(2,4-dichlorophenoxy)-5-(pyridin-2-ylmethyl)phenol (C18 H13 Cl2 N O2, 346.2 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds…

Component
8PC
Formula
C18 H13 Cl2 N O2
Class
ligand
Structures
4
PDB entries
2

Binding sites

8PC in 4 structures; the first of them:

  • 2OP1 · Crystal structure of plasmodium falciparum enoyl ACP reductase with triclosan reductase · 8PC A500 · binds ALA217, ASN218, ALA219, VAL222, TYR267, VAL274, TYR277, MET281 and 4 more
  • 3FNE · Crystal structure of InhA bound to triclosan derivative 17 · 8PC A400 · binds GLY96, PHE97, MET98, MET103, PHE149, TYR158, MET161, LYS165 and 6 more
  • 2OP1 · Crystal structure of plasmodium falciparum enoyl acp reductase with triclosan reductase · 8PC A500 · binds ALA217, ASN218, ALA219, VAL222, TYR267, VAL274, TYR277, MET281 and 4 more
  • 3FNE · Crystal structure of inha bound to triclosan derivative 17 · 8PC A400 · binds GLY96, PHE97, MET98, MET103, PHE149, TYR158, MET161, LYS165 and 6 more

Residues it binds most

MET 12, ALA 12, PHE 12, TYR 12, ILE 12, LYS 12, VAL 6, GLY 8, LEU 8, PRO 8 (residue and the binding sites it lines).

Found with

  • NAD · Nicotinamide-adenine-dinucleotide

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