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Ligand · H96

H96 · [2,7-dimethoxy-9-[[(3R)-pyrrolidin-3-yl]methylsulfanyl]acridin-4-yl]methanol

H96, [2,7-dimethoxy-9-[[(3R)-pyrrolidin-3-yl]methylsulfanyl]acridin-4-yl]methanol (C21 H24 N2 O3 S, 384.5 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every binding site with its residues within 4.5 Å…

Component
H96
Formula
C21 H24 N2 O3 S
Class
ligand
Structures
1
PDB entries
1

Binding sites

H96 in 1 structure; the first of them:

  • 7DL6 · The co-crystal structure of DYRK2 with a small molecule inhibitor 18 · H96 A601 · binds ILE228, GLY229, PHE233, VAL236, ALA249, LYS251, GLU266, ILE285 and 11 more
  • 7DL6 · The co-crystal structure of DYRK2 with a small molecule inhibitor 18 · H96 A601 · binds ILE228, PHE233, VAL236, ALA249, GLU266, ILE285, PHE301, GLU302 and 8 more

Residues it binds most

GLU 2, ILE 2, LEU 2, PHE 2, ASN 2, ALA 2, ASP 2, SER 2, VAL 2, GLY 1 (residue and the binding sites it lines).

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