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Ligand · IE2

IE2 · 4-(7-methylpyrazolo[3',4':4,5]thiopyrano[2,3-b]pyridin-1(4H)-yl)benzenesulfonamide

IE2, 4-(7-methylpyrazolo[3',4':4,5]thiopyrano[2,3-b]pyridin-1(4H)-yl)benzenesulfonamide (C16 H14 N4 O2 S2, 358.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within…

Component
IE2
Formula
C16 H14 N4 O2 S2
Class
ligand
Structures
2
PDB entries
1

Binding sites

IE2 in 2 structures; the first of them:

  • 3QYK · Human Carbonic Anhydrase II complexed with triple ring benzene sulfonamide inhibitor · IE2 A263 · binds TRP5, ASN62, HIS64, GLN92, HIS94, HIS96, GLU106, HIS119 and 11 more
  • 3QYK · Human carbonic anhydrase II complexed with triple ring benzene sulfonamide inhibitor · IE2 A263 · binds TRP5, ASN62, HIS64, GLN92, HIS94, HIS96, GLU106, HIS119 and 11 more

Residues it binds most

HIS 2, VAL 2, PRO 2, THR 2, TRP 2, ASN 2, GLN 2, GLU 2, LEU 2, PHE 2 (residue and the binding sites it lines).

Found with

  • ZN · Zinc ion
  • DMS · Dimethyl sulfoxide

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