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Ligand · BPI

BPI · (1S)-1,2,3,4-tetrahydro-benzo[c]phenanthrene-2,3,4-triol

BPI, (1S)-1,2,3,4-tetrahydro-benzo[c]phenanthrene-2,3,4-triol (C18 H16 O3, 280.3 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
BPI
Formula
C18 H16 O3
Class
ligand
Structures
4
PDB entries
2

Binding sites

BPI in 4 structures; the first of them:

  • 1HWV · Molecular topology of polycyclic aromatic carcinogens determines DNA adduct conformation… · BPI A25 · binds DC5, DG6, DC7, DT8, DG16, DC17, DG18
  • 2I9G · DNA Polymerase Beta with a Benzo[c]phenanthrene diol epoxide adducted guanine base · BPI T100 · binds DOC10, DG6, DG7, ASN37, ARG40, TYR271
  • 1HWV · Molecular topology of polycyclic aromatic carcinogens determines DNA adduct conformation… · BPI A25 · binds DC5, DG6, DC7, DT8, DG16, DC17, DG18
  • 2I9G · DNA polymerase beta with a BENZO[C]PHENANTHRENE diol epoxide adducted guanine base · BPI T100 · binds DOC10, DG6, DG7, ASN37, ARG40, TYR271

Residues it binds most

DG 4, DC 2, ARG 2, ASN 2, DOC 2, DT 2, TYR 2 (residue and the binding sites it lines).

Found with

  • NA · Sodium ion
  • CL · Chloride ion

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