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Ligand · ND8

ND8 · benzothiophene 2 carboxylic acid

ND8, benzothiophene 2 carboxylic acid (C9 H6 O2 S, 178.2 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the ligands found…

Component
ND8
Formula
C9 H6 O2 S
Class
ligand
Structures
2
PDB entries
2

Binding sites

ND8 in 2 structures; the first of them:

  • 6TIC · Structure of A. niger Fdc I327S variant in complex with benzothiophene 2 carboxylic acid · ND8 AAA605 · binds ARG173, LEU185, ILE187, GLN190, PHE280, GLU282, MET283, CYS316 and 5 more
  • 6TIO · Structure of A. niger Fdc Wt in complex with FMN and benzothiophene 2 carboxylic acid · ND8 AAA605 · binds ARG173, LEU185, ILE187, GLN190, PHE280, GLU282, MET283, CYS316 and 6 more

Residues it binds most

LEU 2, PHE 2, THR 2, ILE 2, ARG 2, CYS 2, GLN 2, GLU 2, MET 2, TYR 2 (residue and the binding sites it lines).

Found with

  • K · Potassium ion
  • MN · Manganese (II) ion
  • BYN · hydroxylated prenyl-FMN
  • FMN · Flavin mononucleotide

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