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Ligand · 7DK

7DK · Methyl ((15S)-15-(((2E)-3-(5-chloro-2-(1H-tetrazol-1-yl)phenyl)-2-propenoyl)amino)-9-oxo-8,17,19-triazatricyclo[14.2.1.0~2,7~]nonadeca-1(18),2,4,6, 16(19)-pentaen-5-yl)carbamate

7DK, Methyl ((15S)-15-(((2E)-3-(5-chloro-2-(1H-tetrazol-1-yl)phenyl)-2-propenoyl)amino)-9-oxo-8,17,19-triazatricyclo[14.2.1.0~2,7~]nonadeca-1(18),2,4,6, 16(19)-pentaen-5-yl)carbamate (C28 H28 Cl N9 O4, 590.0 g/mol), in the MolNFT…

Component
7DK
Formula
C28 H28 Cl N9 O4
Class
ligand
Structures
1
PDB entries
1

Binding sites

7DK in 1 structure; the first of them:

  • 5TKU · Factor xia in complex with the inhibitor methyl ((15S)-15-(((2E)-3-(5… · 7DK A301 · binds ARG39, HIS40, LEU41, HIS57, LEU147, ILE151, ASP189, ALA190 and 14 more

Residues it binds most

GLY 1, ASP 1, CYS 1, HIS 1, LEU 1, SER 1, ALA 1, ARG 1, ILE 1, LYS 1 (residue and the binding sites it lines).

Found with

  • SO4 · Sulfate ion
  • EDO · 1,2-ethanediol

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