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Ligand · 21T

21T · 4-[4-(2-adamantylcarbamoyl)-5-tert-butyl-pyrazol-1-yl]benzoic acid

21T, 4-[4-(2-adamantylcarbamoyl)-5-tert-butyl-pyrazol-1-yl]benzoic acid (C25 H31 N3 O3, 421.5 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…

Component
21T
Formula
C25 H31 N3 O3
Class
ligand
Structures
2
PDB entries
1

Binding sites

21T in 2 structures; the first of them:

  • 4P38 · Human 11beta-Hydroxysteroid Dehydrogenase Type 1 in complex with AZD8329 · 21T A302 · binds ILE121, THR124, LEU126, SER170, LEU171, ALA172, TYR177, VAL180 and 9 more
  • 4P38 · Human 11BETA-hydroxysteroid dehydrogenase type 1 in complex with AZD8329 · 21T A302 · binds ILE121, THR124, LEU126, SER170, LEU171, ALA172, TYR177, VAL180 and 9 more

Residues it binds most

LEU 4, TYR 4, ALA 4, THR 4, GLY 4, ILE 4, MET 4, SER 4, VAL 4 (residue and the binding sites it lines).

Found with

  • NDP · Nadph dihydro-nicotinamide-adenine-dinucleotide phosphate
  • CL · Chloride ion

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