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DB01083 : orlistat

Approved drug orlistat ... 3 targets DB01083

Generic name: orlistat
 
Brand name(s): alli, xenical.
Formula: C29H53No5
IUPAC Formula: (2s)-1-[(2s,3s)-3-Hexyl-4-Oxooxetan-2-Yl]tridecan-2-Yl (2s)-2-Formamido-4-Methylpentanoate

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

DrugBank drug Target 1:   UniProt id: P16233 (LIPP_HUMAN)  -  Pancreatic triacylglycerol lipase
UniProt id: P16233    464 a.a.  
1. 1lpb B     449 a.a. 449   X-ray 2.46 Å
  2. 1lpa B     449 a.a. 449   X-ray 3.04 Å
  3. 1n8s A     449 a.a. 449   X-ray 3.04 Å
  4. 1gpl A     432 a.a. 328   X-ray 2.01 Å
There are no PDB entries containing orlistat bound to this target protein, although there are 4 entries of the target protein (click the orange, plus icon for a list).
DrugBank drug Target 2:   UniProt id: P07098 (LIPG_HUMAN)  -  Gastric triacylglycerol lipase
UniProt id: P07098    397 a.a.  
1hlg A,B     368 a.a. 368   X-ray 3.00 Å
There are no PDB entries containing orlistat bound to this target protein, although there is 1 entry of the target protein in the PDB (see above).
DrugBank drug Target 3:   UniProt id: P49327 (FAS_HUMAN)  -  Fatty acid synthase
UniProt id: P49327    2510 a.a.  
1. 3hhd A,B,C,D     852 a.a. 851   X-ray 2.15 Å
  2. 2jfd A,B,C,D     404 a.a. 401   X-ray 2.81 Å
  3. 2jfk A,B,C,D     400 a.a. 396   X-ray 2.40 Å
  4. 3tjm A     275 a.a. 271   X-ray 1.48 Å
  5. 1xkt A,B     260 a.a. 258   X-ray 2.60 Å
   more ...
There are no PDB entries containing orlistat bound to this target protein, although there are 7 entries of the target protein (click the orange, plus icon for a list).

Key:    PfamA domain  PfamB domain  Secondary structure  Bound drug molecule

The black crosses on the secondary structure diagrams indicate where the PDB and UniProt sequences differ.

 

 

Structure selection

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