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Ligand · TSR

TSR · 2-(1H-indol-3-yl)acetamide

TSR, 2-(1H-indol-3-yl)acetamide (C10 H10 N2 O, 174.2 g/mol), in the MolNFT structures on GenesisL1: bound in 6 records (3 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the ligands found…

Component
TSR
Formula
C10 H10 N2 O
Class
ligand
Structures
6
PDB entries
3

Binding sites

TSR in 6 structures; the first of them:

  • 2OIZ · Crystal Structure of the Tryptamine-Derived (Indol-3-Acetamide)-TTQ Adduct of Aromatic… · TSR D1702 · binds ASP84, GLY85, TRQ109, ASP128, ASN156, ASP157, VAL158, ASN159 and 9 more
  • 2OJY · Crystal structure of indol-3-acetaldehyde derived TTQ-amide adduct of aromatic amine… · TSR D292 · binds ASP84, GLY85, TRQ109, ASP128, ASN156, ASP157, VAL158, ASN159 and 7 more
  • 4IV9 · Structure of the Flavoprotein Tryptophan-2-Monooxygenase · TSR A602 · binds ARG98, PHE244, VAL247, MET258, TRP415, PHE476, LEU478, GLY517 and 2 more
  • 2OIZ · Crystal structure of the tryptamine-derived (indol-3-acetamide)-ttq adduct of aromatic… · TSR D1702 · binds ASP84, GLY85, TRQ109, ASP128, ASN156, ASP157, VAL158, ASN159 and 9 more
  • 2OJY · Crystal structure of indol-3-acetaldehyde derived ttq-amide adduct of aromatic amine… · TSR D292 · binds ASP84, GLY85, TRQ109, ASP128, ASN156, ASP157, VAL158, ASN159 and 7 more
  • 4IV9 · Structure of the flavoprotein tryptophan-2-monooxygenase · TSR A602 · binds ARG98, PHE244, VAL247, MET258, TRP415, PHE476, LEU478, GLY517 and 2 more

Residues it binds most

PHE 12, ASP 8, ASN 8, GLY 12, LEU 12, TRP 8, VAL 12, GLN 8, THR 8, TRQ 8 (residue and the binding sites it lines).

Found with

  • FAD · Flavin-adenine dinucleotide
  • PO4 · Phosphate ion
  • EDO · 1,2-ethanediol
  • PG4 · Tetraethylene glycol

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