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Ligand · 0T0

0T0 · 3-(3,4-dihydroisoquinolin-2(1H)-ylsulfonyl)-N-methylbenzamide

0T0, 3-(3,4-dihydroisoquinolin-2(1H)-ylsulfonyl)-N-methylbenzamide (C17 H18 N2 O3 S, 330.4 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 residues it…

Component
0T0
Formula
C17 H18 N2 O3 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

0T0 in 2 structures; the first of them:

  • 4FAL · Crystal structure of human 17beta-hydroxysteroid dehydrogenase type 5 in complex with… · 0T0 A402 · binds TYR24, LEU54, TYR55, TRP86, HIS117, SER118, MET120, ASN167 and 7 more
  • 4FAL · Crystal structure of human 17BETA-hydroxysteroid dehydrogenase type 5 in complex with… · 0T0 A402 · binds TYR24, LEU54, TYR55, TRP86, HIS117, SER118, MET120, ASN167 and 7 more

Residues it binds most

TYR 2, PHE 2, SER 2, TRP 2, ASN 2, HIS 2, LEU 2, MET 2 (residue and the binding sites it lines).

Found with

  • NAP · Nadp nicotinamide-adenine-dinucleotide phosphate
  • EDO · 1,2-ethanediol

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