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Ligand · 6JP

6JP · (2S)-5,7-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-2,3-dihydro-4H-1-benzopyran-4-one

6JP, (2S)-5,7-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-2,3-dihydro-4H-1-benzopyran-4-one (C16 H14 O6, 302.3 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (2 PDB entries). Every binding site with its residues within 4.5…

Component
6JP
Formula
C16 H14 O6
Class
ligand
Structures
2
PDB entries
2

Binding sites

6JP in 2 structures; the first of them:

  • 5JDC · Trypanosoma brucei PTR1 in complex with inhibitor NP-13 (Hesperetin) · 6JP A302 · binds ARG14, SER95, PHE97, ASP161, MET163, GLN166, PRO167, CSX168 and 7 more
  • 7POU · Crystal structure of profragilysin-3 (proBFT-3) from Bacteroides fragilis in complex with… · 6JP A402 · binds TYR221, ILE223, LEU225, VAL263, TYR265, THR266, ASN290, LYS292 and 4 more

Residues it binds most

TYR 6, LEU 6, PRO 4, SER 4, ARG 4, ASP 4, CSX 4, GLN 4, GLY 4, HIS 4 (residue and the binding sites it lines).

Found with

  • NAP · Nadp nicotinamide-adenine-dinucleotide phosphate
  • PRO · Proline
  • ZN · Zinc ion
  • ACT · Acetate ion
  • DMS · Dimethyl sulfoxide
  • GOL · Glycerol

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