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Ligand · RJB

RJB · 2-[2-(1,3-benzothiazol-2-ylmethylcarbamoyl)-1,3-dihydroinden-2-yl]ethanoic acid

RJB, 2-[2-(1,3-benzothiazol-2-ylmethylcarbamoyl)-1,3-dihydroinden-2-yl]ethanoic acid (C20 H18 N2 O3 S, 366.4 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every binding site with its residues within 4.5 Å…

Component
RJB
Formula
C20 H18 N2 O3 S
Class
ligand
Structures
1
PDB entries
1

Binding sites

RJB in 1 structure; the first of them:

  • 7AJR · Virtual screening approach leading to the identification of a novel and tractable series… · RJB AAA401 · binds GLU111, ASN112, ALA113, MET128, PHE129, LEU132, VAL137, HIS140 and 10 more

Residues it binds most

GLU 1, HIS 1, ILE 1, LEU 1, ALA 1, ARG 1, ASN 1, GLY 1, MET 1, PHE 1 (residue and the binding sites it lines).

Found with

  • ZN · Zinc ion
  • SO4 · Sulfate ion

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