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Ligand · DT9

DT9 · (1S)-6,7-dimethoxy-1-methyl-3,4-dihydroisoquinoline-2(1H)-sulfonamide

DT9, (1S)-6,7-dimethoxy-1-methyl-3,4-dihydroisoquinoline-2(1H)-sulfonamide (C12 H18 N2 O4 S, 286.4 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, the…

Component
DT9
Formula
C12 H18 N2 O4 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

DT9 in 2 structures; the first of them:

  • 3PO6 · Crystal structure of human carbonic anhydrase II with… · DT9 A262 · binds ASN62, ASN67, ILE91, GLN92, HIS94, HIS96, GLU106, HIS119 and 9 more
  • 3PO6 · Crystal structure of human carbonic anhydrase II with 6,7-dimethoxy-1… · DT9 A262 · binds ASN62, ASN67, ILE91, GLN92, HIS94, HIS96, GLU106, HIS119 and 9 more

Residues it binds most

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

Found with

  • RDT · (1R)-6,7-dimethoxy-1-methyl-3,4-dihydroisoquinoline-2(1H)-sulfonamide
  • ZN · Zinc ion
  • ACT · Acetate ion
  • GOL · Glycerol

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