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DB00337 : pimecrolimus

Approved drug pimecrolimus ... 2 targets DB00337

Generic name: pimecrolimus
 
Brand name(s): elidel.
Formula: C43H68Clno11
IUPAC Formula: (1r,9s,12s,13s,14s,17r,21s,23s,24r,25s,27r)-12-[(1e)-1-[(1r,3r,4s)-4-Chloro-3-
Methoxycyclohexyl]prop-1-En-2-Yl]-17-Ethyl-1,14-Dihydroxy-23,25-Dimethoxy-13,19,21,27-Tetramethyl-
11,28-Dioxa-4-Azatricyclo[22.3.1.0^{4,9}]octacos-18-Ene-2,3,10,16-Tetrone

2
There are 2 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: P42345 (MTOR_HUMAN)  -  Serine/threonine-protein kinase mTOR
UniProt id: P42345    2548 a.a.  
1. 4jsn B,A     1058 a.a. 1058   X-ray 3.20 Å
  2. 4jsp B,A     1058 a.a. 1058   X-ray 3.30 Å
  3. 4jt5 B,A     1058 a.a. 1058   X-ray 3.45 Å
  4. 4jsv B,A     1058 a.a. 1058   X-ray 3.50 Å
  5. 4jsx B,A     1058 a.a. 1058   X-ray 3.50 Å
   more ...
There are no PDB entries containing pimecrolimus bound to this target protein, although there are 18 entries of the target protein (click the orange, plus icon for a list).
DrugBank drug Target 2:   UniProt id: P62942 (FKB1A_HUMAN)  -  FK506-binding protein 1A
UniProt id: P62942    107 a.a.  
1. 2ppn A     107 a.a. 107   X-ray
  2. 1fkb A     107 a.a. 107   X-ray 1.70 Å
  3. 1fkf A     107 a.a. 107   X-ray 1.70 Å
  4. 1fkj A     107 a.a. 107   X-ray 1.70 Å
  5. 2dg3 A     107 a.a. 107   X-ray 1.70 Å
   more ...
There are no PDB entries containing pimecrolimus bound to this target protein, although there are 43 entries of the target protein (click the orange, plus icon for a list).

Key:    PfamA domain  Secondary structure  Bound drug molecule

 

 

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