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Ligand · KPK

KPK · 4-({1-[(4-methyl-1-benzothiophen-3-yl)methyl]-1H-benzimidazol-2-yl}sulfanyl)butanoic acid

KPK, 4-({1-[(4-methyl-1-benzothiophen-3-yl)methyl]-1H-benzimidazol-2-yl}sulfanyl)butanoic acid (C21 H20 N2 O2 S2, 396.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues…

Component
KPK
Formula
C21 H20 N2 O2 S2
Class
ligand
Structures
2
PDB entries
1

Binding sites

KPK in 2 structures; the first of them:

  • 4KP0 · Crystal Structure of the human Chymase with TJK002 · KPK A301 · binds LYS40, PHE41, CYS42, HIS57, CYS58, LEU99, ALA190, PHE191 and 11 more
  • 4KP0 · Crystal structure of the human chymase with TJK002 · KPK A301 · binds LYS40, PHE41, CYS42, HIS57, CYS58, LEU99, ALA190, PHE191 and 11 more

Residues it binds most

SER 2, ALA 2, CYS 2, GLY 2, LYS 2, PHE 2, ARG 2, ASP 2, HIS 2, LEU 2 (residue and the binding sites it lines).

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