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DB01117 : atovaquone

Approved drug atovaquone ... 3 targets DB01117

Generic name: atovaquone
 
Brand name(s): malarone pediatric.
Formula: C22H19Clo3
IUPAC Formula: 2-Hydroxy-3-[(1r,4r)-4-(4-Chlorophenyl)cyclohexyl]-1,4-Dihydronaphthalene-1,4-Dione

3
There are 3 target proteins defined in DrugBank for this drug.
 2 
2 of these target proteins have one or more structures in the PDB.
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Target proteins

DrugBank drug Target 1:   UniProt id: Q02768 (CYB_PLAFA)  -  Cytochrome b
UniProt id: Q02768    376 a.a.  
 
There are no structures of the target protein in the PDB (click icon on left for list of closest matches)
DrugBank drug Target 2:   UniProt id: Q08210 (PYRD_PLAF7)  -  Dihydroorotate dehydrogenase homolog, mitochondrial
UniProt id: Q08210    568 a.a.  
1. 3i68 A     378 a.a. 378   X-ray 2.40 Å
  2. 3i6r A     376 a.a. 376   X-ray 2.50 Å
  3. 4cq8 A,B     378 a.a. 375   X-ray 1.98 Å
  4. 4orm A     375 a.a. 375   X-ray 2.07 Å
  5. 3o8a A     375 a.a. 375   X-ray 2.30 Å
   more ...
There are no PDB entries containing atovaquone bound to this target protein, although there are 10 entries of the target protein (click the orange, plus icon for a list).
DrugBank drug Target 3:   UniProt id: Q02127 (PYRD_HUMAN)  -  Dihydroorotate dehydrogenase, mitochondrial
UniProt id: Q02127    394 a.a.  
1. 3w7r A     367 a.a. 367   X-ray 1.68 Å
  2. 2prl A     367 a.a. 367   X-ray 2.10 Å
  3. 2prm A     367 a.a. 367   X-ray 3.00 Å
  4. 3kvm A     366 a.a. 366   X-ray 2.00 Å
  5. 3u2o A     366 a.a. 366   X-ray 2.18 Å
   more ...
There are no PDB entries containing atovaquone bound to this target protein, although there are 32 entries of the target protein (click the orange, plus icon for a list).

Key:    PfamA domain  PfamB domain  Secondary structure  Bound drug molecule

 

 

Structure selection

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