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Ligand · 2HK

2HK · 4'-{6-methoxy-7-[2-(piperidin-1-yl)ethoxy]-1,2-dihydroindeno[1,2-c]pyrazol-3-yl}biphenyl-4-ol

2HK, 4'-{6-methoxy-7-[2-(piperidin-1-yl)ethoxy]-1,2-dihydroindeno[1,2-c]pyrazol-3-yl}biphenyl-4-ol (C30 H31 N3 O3, 481.6 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues…

Component
2HK
Formula
C30 H31 N3 O3
Class
ligand
Structures
2
PDB entries
1

Binding sites

2HK in 2 structures; the first of them:

  • 4FTN · Crystal Structure of the CHK1 · 2HK A301 · binds GLN13, LEU15, VAL23, ALA36, LYS38, GLU55, ASN59, VAL68 and 12 more
  • 4FTN · Crystal structure of the CHK1 · 2HK A301 · binds GLN13, LEU15, VAL23, ALA36, LYS38, GLU55, ASN59, VAL68 and 12 more

Residues it binds most

GLU 2, LEU 2, GLY 2, SER 2, VAL 2, ALA 2, ASN 2, ASP 2, CYS 2, GLN 2 (residue and the binding sites it lines).

Found with

  • SO4 · Sulfate ion
  • GOL · Glycerol
  • IPA · Isopropyl alcohol

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