GL1X · GenesisL1 explorer

Ligand · B66

B66 · 4-{[(1R,2S)-1,2-dihydroxy-2-methyl-3-(4-nitrophenoxy)propyl]amino}-2-(trifluoromethyl)benzonitrile

B66, 4-{[(1R,2S)-1,2-dihydroxy-2-methyl-3-(4-nitrophenoxy)propyl]amino}-2-(trifluoromethyl)benzonitrile (C18 H16 F3 N3 O5, 411.3 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its…

Component
B66
Formula
C18 H16 F3 N3 O5
Class
ligand
Structures
2
PDB entries
1

Binding sites

B66 in 2 structures; the first of them:

  • 3B66 · Crystal structure of the androgen receptor ligand binding domain in complex with SARM S-21 · B66 A1 · binds LEU701, LEU704, ASN705, LEU707, GLY708, GLN711, GLN738, TRP741 and 16 more
  • 3B66 · Crystal structure of the androgen receptor ligand binding domain in complex with sarm S-21 · B66 A1 · binds LEU701, LEU704, ASN705, LEU707, GLY708, GLN711, GLN738, TRP741 and 16 more

Residues it binds most

MET 2, LEU 2, GLN 2, ILE 2, PHE 2, VAL 2, ARG 2, ASN 2, GLY 2, HIS 2 (residue and the binding sites it lines).

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