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Ligand · 4KD

4KD · 4-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)carbonyl]benzenesulfonamide

4KD, 4-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)carbonyl]benzenesulfonamide (C18 H20 N2 O5 S, 376.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å…

Component
4KD
Formula
C18 H20 N2 O5 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

4KD in 2 structures; the first of them:

  • 4Z1N · Carbonic anhydrase inhibitors: Design and synthesis of new… · 4KD A302 · binds GLN92, HIS94, HIS96, GLU106, HIS119, VAL121, PHE130, VAL134 and 7 more
  • 4Z1N · Carbonic anhydrase inhibitors: design and synthesis of new heteroaryl… · 4KD A302 · binds GLN92, HIS94, HIS96, GLU106, HIS119, VAL121, PHE130, VAL134 and 7 more

Residues it binds most

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

Found with

  • ZN · Zinc ion

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