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Ligand · N11

N11 · 6-[(7-nitro-2,1,3-benzoxadiazol-4-yl)sulfanyl]hexan-1-ol

N11, 6-[(7-nitro-2,1,3-benzoxadiazol-4-yl)sulfanyl]hexan-1-ol (C12 H15 N3 O4 S, 297.3 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…

Component
N11
Formula
C12 H15 N3 O4 S
Class
ligand
Structures
4
PDB entries
2

Binding sites

N11 in 4 structures; the first of them:

  • 3GUS · Crystal strcture of human Pi class glutathione S-transferase GSTP1-1 in complex with… · N11 A211 · binds TYR7, PHE8, VAL10, ARG13, VAL35, TRP38, GLN39, ILE104 and 2 more
  • 3IE3 · Structural basis for the binding of the anti-cancer compound… · N11 A211 · binds TYR7, PHE8, ARG13, TRP38, GLN39, ALA104, TYR108, GLY205
  • 3GUS · Crystal strcture of human pi class glutathione S-transferase GSTP1-1 in complex with… · N11 A211 · binds TYR7, PHE8, VAL10, ARG13, VAL35, TRP38, GLN39, ILE104 and 2 more
  • 3IE3 · Structural basis for the binding of the anti-cancer compound 6-(7… · N11 A211 · binds TYR7, PHE8, ARG13, TRP38, GLN39, ALA104, TYR108, GLY205

Residues it binds most

TYR 8, VAL 6, ARG 8, GLY 8, PHE 8, GLN 6, TRP 6, ALA 4, ILE 4 (residue and the binding sites it lines).

Found with

  • GSH · Glutathione
  • MES · 2-(N-morpholino)-ethanesulfonic acid
  • SO4 · Sulfate ion

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