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Ligand · AOI

AOI · Androsterone

AOI, Androsterone (C19 H30 O2, 290.4 g/mol), in the MolNFT structures on GenesisL1: bound in 6 records (3 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the ligands found with it.

Component
AOI
Formula
C19 H30 O2
Class
ligand
Structures
6
PDB entries
3

Binding sites

AOI in 6 structures; the first of them:

  • 1NFQ · Rv2002 gene product from Mycobacterium tuberculosis · AOI A401 · binds LEU92, ILE94, GLU142, THR147, VAL148, ALA149, CYS150, TYR153 and 8 more
  • 1X8J · Crystal structure of retinol dehydratase in complex with androsterone and inactive… · AOI A400 · binds PHE31, TYR105, GLY108, ILE111, TYR120, ILE123, TYR135, LEU138 and 6 more
  • 1YB1 · Crystal structure of human 17-beta-hydroxysteroid dehydrogenase type XI · AOI A602 · binds THR147, LYS148, LEU151, PRO152, THR155, LEU194, GLU197, LEU201 and 5 more
  • 1NFQ · RV2002 gene product from mycobacterium tuberculosis · AOI A401 · binds LEU92, ILE94, GLU142, THR147, VAL148, ALA149, CYS150, TYR153 and 8 more
  • 1X8J · Crystal structure of retinol dehydratase in complex with androsterone and inactive… · AOI A400 · binds PHE31, TYR105, GLY108, ILE111, TYR120, ILE123, TYR135, LEU138 and 6 more
  • 1YB1 · Crystal structure of human 17-beta-hydroxysteroid dehydrogenase type XI · AOI A602 · binds THR147, LYS148, LEU151, PRO152, THR155, LEU194, GLU197, LEU201 and 5 more

Residues it binds most

LEU 14, ILE 14, TYR 12, THR 12, VAL 10, PHE 14, MET 12, GLU 10, ALA 8, CYS 8 (residue and the binding sites it lines).

Found with

  • A3P · Adenosine-3'-5'-diphosphate
  • NAI · 1,4-dihydronicotinamide adenine dinucleotide
  • CA · Calcium ion
  • CL · Chloride ion
  • SO4 · Sulfate ion
  • GOL · Glycerol

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