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Ligand · 0G1

0G1 · 3-[3-(4-methoxyphenyl)-2-(1H-thieno[3,2-c]pyrazol-3-yl)-1H-indol-6-yl]pentan-3-ol

0G1, 3-[3-(4-methoxyphenyl)-2-(1H-thieno[3,2-c]pyrazol-3-yl)-1H-indol-6-yl]pentan-3-ol (C25 H25 N3 O2 S, 431.6 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5…

Component
0G1
Formula
C25 H25 N3 O2 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

0G1 in 2 structures; the first of them:

  • 3V5L · Crystal Structure of Interleukin-2 Inducible T-cell Kinase Itk Catalytic Domain with… · 0G1 A701 · binds ILE369, GLY370, VAL377, LEU379, ALA389, PHE435, GLU436, PHE437 and 10 more
  • 3V5L · Crystal structure of interleukin-2 inducible T-cell kinase itk catalytic domain with… · 0G1 A701 · binds ILE369, GLY370, VAL377, LEU379, ALA389, PHE435, GLU436, PHE437 and 10 more

Residues it binds most

GLU 8, GLY 8, ILE 8, PHE 8, LEU 8, ALA 8, CYS 8, GLN 8, HIS 8, MET 8 (residue and the binding sites it lines).

Found with

  • SO4 · Sulfate ion

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