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Ligand · FFA

FFA · (10alpha,13alpha,14beta,17alpha)-17-hydroxyandrost-4-en-3-one

FFA, (10alpha,13alpha,14beta,17alpha)-17-hydroxyandrost-4-en-3-one (C19 H28 O2, 288.4 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…

Component
FFA
Formula
C19 H28 O2
Class
ligand
Structures
6
PDB entries
3

Binding sites

FFA in 6 structures; the first of them:

  • 2IPF · Crystal structure of 17alpha-hydroxysteroid dehydrogenase in complex with NADP+ and… · FFA A3 · binds LEU25, PRO26, LEU27, LYS31, VAL54, TYR55, TRP86, HIS117 and 5 more
  • 2IPG · Crystal structure of 17alpha-hydroxysteroid dehydrogenase mutant K31A in complex with… · FFA A3 · binds ALA24, LEU25, PRO26, LEU27, VAL54, TYR55, TRP86, HIS117 and 5 more
  • 2IPJ · Crystal structure of h3alpha-hydroxysteroid dehydrogenase type 3 mutant Y24A in complex… · FFA A325 · binds VAL54, TYR55, TRP86, HIS117, VAL128, ILE129, TRP227, LEU306 and 1 more
  • 2IPF · Crystal structure of 17ALPHA-hydroxysteroid dehydrogenase in complex with NADP+ and… · FFA A3 · binds LEU25, PRO26, LEU27, LYS31, VAL54, TYR55, TRP86, HIS117 and 5 more
  • 2IPG · Crystal structure of 17ALPHA-hydroxysteroid dehydrogenase mutant K31A in complex with… · FFA A3 · binds ALA24, LEU25, PRO26, LEU27, VAL54, TYR55, TRP86, HIS117 and 5 more
  • 2IPJ · Crystal structure of H3ALPHA-hydroxysteroid dehydrogenase type 3 mutant Y24A in complex… · FFA A325 · binds VAL54, TYR55, TRP86, HIS117, VAL128, ILE129, TRP227, LEU306 and 1 more

Residues it binds most

TYR 12, LEU 12, TRP 12, VAL 12, HIS 12, ILE 12, PHE 8, PRO 8, ALA 4, LYS 4 (residue and the binding sites it lines).

Found with

  • NAP · Nadp nicotinamide-adenine-dinucleotide phosphate
  • BME · Beta-mercaptoethanol
  • EDO · 1,2-ethanediol
  • SO4 · Sulfate ion
  • TRS · 2-amino-2-hydroxymethyl-propane-1,3-diol

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