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Ligand · DKK

DKK · N-[2-(carbamimidamidooxy)ethyl]-2-{6-cyano-3-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-2-fluorophenyl}acetamide

DKK, N-[2-(carbamimidamidooxy)ethyl]-2-{6-cyano-3-[(2,2-difluoro-2-pyridin-2-ylethyl)amino]-2-fluorophenyl}acetamide (C19 H20 F3 N7 O2, 435.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding…

Component
DKK
Formula
C19 H20 F3 N7 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

DKK in 2 structures; the first of them:

  • 3C27 · Cyanofluorophenylacetamides as Orally Efficacious Thrombin Inhibitors · DKK B5000 · binds HIS79, TYR83, TRP86, GLU130, ASN131, LEU132, ILE209, ASP229 and 12 more
  • 3C27 · Cyanofluorophenylacetamides as orally efficacious thrombin inhibitors · DKK B5000 · binds HIS79, TYR83, TRP86, GLU130, ASN131, LEU132, ILE209, ASP229 and 12 more

Residues it binds most

GLU 2, GLY 2, CYS 2, SER 2, TRP 2, ALA 2, ASN 2, ASP 2, HIS 2, ILE 2 (residue and the binding sites it lines).

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