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Ligand · EMD

EMD · 5-[1-(3,4-dimethoxy-benzoyl)-1,2,3,4-tetrahydro-quinolin-6-yl]-6-methyl-3,6-dihydro-[1,3,4]thiadiazin-2-one

EMD, 5-[1-(3,4-dimethoxy-benzoyl)-1,2,3,4-tetrahydro-quinolin-6-yl]-6-methyl-3,6-dihydro-[1,3,4]thiadiazin-2-one (C22 H23 N3 O4 S, 425.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site…

Component
EMD
Formula
C22 H23 N3 O4 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

EMD in 2 structures; the first of them:

  • 1IH0 · Structure of the C-domain of Human Cardiac Troponin C in Complex with Ca2+ Sensitizer EMD… · EMD A1 · binds PHE104, ILE112, LEU117, LEU121, THR124, LEU136, GLY140, ILE148 and 5 more
  • 1IH0 · Structure of the C-domain of human cardiac troponin C in complex with CA2+ sensitizer emd… · EMD A1 · binds PHE104, ILE112, LEU117, LEU121, THR124, LEU136, GLY140, ILE148 and 5 more

Residues it binds most

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

Found with

  • CA · Calcium ion

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