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Ligand · 46T

46T · (1E,2E)-N,N'-di(propan-2-yl)cyclohepta-3,5-diene-1,2-diimine

46T, (1E,2E)-N,N'-di(propan-2-yl)cyclohepta-3,5-diene-1,2-diimine (C13 H20 N2, 204.3 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å, the residues it binds…

Component
46T
Formula
C13 H20 N2
Class
ligand
Structures
2
PDB entries
1

Binding sites

46T in 2 structures; the first of them:

  • 4Y43 · Endothiapepsin in complex with fragment 42 · 46T A403 · binds ASP15, THR223, LEU224, VAL248, GLY249, PHE280, PRO282, ILE283 and 1 more
  • 4Y43 · Endothiapepsin in complex with fragment 42 · 46T A403 · binds ASP15, THR223, LEU224, VAL248, GLY249, PHE280, PRO282, ILE283 and 1 more

Residues it binds most

PHE 2, ASP 2, GLY 2, ILE 2, LEU 2, PRO 2, THR 2, VAL 2 (residue and the binding sites it lines).

Found with

  • EDO · 1,2-ethanediol
  • GOL · Glycerol

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