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DB00421 : spironolactone

Approved drug spironolactone ... 2 targets DB00421

Generic name: spironolactone PDB Het Group: SNL
 
3 structures in PDB
Brand name(s): abbolactone, acelat, aldace, aldactazide, aldactide, aldactone, aldactone a, alderon, aldopur, almatol, altex, aquareduct, deverol, diatensec, dira, duraspiron, espironolactona [inn-spanish], euteberol, lacalmin, lacdene, laractone, melarcon, nefurofan, osyrol, snl, sagisal, sincomen, spiresis, spiretic, spiridon, spiro-tablinen, spiroctan, spiroctanie, spiroderm, spirolactone, spirolakton, spirolang, spirolone, spirone, spironocompren, spironolactone a, spironolactone [ban:inn:jan], spironolactonum [inn-latin], spironolattone [dcit], sprioderm, supra-puren, suracton, uractone, urusonin, verospiron, verospirone, verospirone opianin, xenalon.
Formula: C24H32O4S
IUPAC Formula: (1'S,2r,2'R,9'R,10'R,11'S,15'S)-9'-(Acetylsulfanyl)-2',15'-Dimethylspiro[oxolane-2,14'-
Tetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadecan]-6'-Ene-5,5'-Dione
PDB name: Spironolactone

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.
 3 
There are 3 PDB structures of the drug molecule bound to its target protein.
Links  
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Pharmacology
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Target proteins

DrugBank drug Target 1:   UniProt id: P08235 (MCR_HUMAN)  -  Mineralocorticoid receptor
UniProt id: P08235    983 a.a.  
1. 2ab2 A,B   259 a.a. 257   X-ray 1.85 Å
  2. 3vhu A   249 a.a. 247   X-ray 2.11 Å
  3. 2oax A,B,C,D,...   233 a.a. 232   X-ray 2.29 Å
The PDB contains 3 entries of spironolactone bound to this target protein and 15 entries of this target protein in all (click on orange, plus icon for list).
DrugBank drug Target 2:   UniProt id: P10275 (ANDR_HUMAN)  -  Androgen receptor
UniProt id: P10275    918 a.a.  
1. 1xj7 A     256 a.a. 256   X-ray 2.70 Å
  2. 1t65 A     251 a.a. 251   X-ray 1.66 Å
  3. 2am9 A     250 a.a. 250   X-ray 1.64 Å
  4. 2pit A     250 a.a. 250   X-ray 1.76 Å
  5. 1t63 A     250 a.a. 250   X-ray 2.07 Å
   more ...
There are no PDB entries containing spironolactone bound to this target protein, although there are 76 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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