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Ligand · CN9

CN9 · 1-methyl-9H-pyrido[3,4-b]indole

CN9, 1-methyl-9H-pyrido[3,4-b]indole (C12 H10 N2, 182.2 g/mol), in the MolNFT structures on GenesisL1: bound in 3 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the ligands found…

Component
CN9
Formula
C12 H10 N2
Class
ligand
Structures
3
PDB entries
2

Binding sites

CN9 in 3 structures; the first of them:

  • 7SVX · Structure of EmrE-D3 mutant in complex with monobody L10 and harmane · CN9 B201 · binds GLU14, TYR40, PHE44, TRP63, PHE44, LEU47, TYR60, TRP63
  • 7Y3V · Crystal structure of CdpNPT in complex with harmane · CN9 A503 · binds LEU109, GLU116, ARG129, ALA131, VAL206, TYR221, PHE223, PHE272 and 4 more
  • 7SVX · Structure of emre-D3 mutant in complex with monobody L10 and harmane · CN9 B201 · binds GLU14, TYR40, TRP63, LEU47, TYR60, TRP63

Residues it binds most

TYR 3, TRP 3, PHE 2, GLU 3, LEU 3, ALA 1, ARG 1, MET 1, VAL 1 (residue and the binding sites it lines).

Found with

  • PO4 · Phosphate ion

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