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Ligand · NN1

NN1 · 2-(2-chloro-4-fluorophenoxy)-2-methyl-N-[(1R,2S,3S,5S,7S)-5-(methylsulfonyl)-2-adamantyl]propanamide

NN1, 2-(2-chloro-4-fluorophenoxy)-2-methyl-N-[(1R,2S,3S,5S,7S)-5-(methylsulfonyl)-2-adamantyl]propanamide (C21 H27 Cl F N O4 S, 444.0 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with…

Component
NN1
Formula
C21 H27 Cl F N O4 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

NN1 in 2 structures; the first of them:

  • 2ILT · Human 11-beta-Hydroxysteroid Dehydrogenase (HSD1) with NADP and Adamantane Sulfone… · NN1 A902 · binds ILE121, THR124, LEU126, SER170, LEU171, ALA172, TYR177, PRO178 and 11 more
  • 2ILT · Human 11-beta-hydroxysteroid dehydrogenase (HSD1) with NADP and adamantane sulfone… · NN1 A902 · binds ILE121, THR124, LEU126, SER170, LEU171, ALA172, TYR177, PRO178 and 11 more

Residues it binds most

LEU 2, ALA 2, VAL 2, THR 2, TYR 2, GLY 2, ILE 2, MET 2, PRO 2, SER 2 (residue and the binding sites it lines).

Found with

  • NAP · Nadp nicotinamide-adenine-dinucleotide phosphate
  • NI · Nickel (II) ion

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