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Target
Spermidine synthase
Ligand
BDBM22111
Substrate
n/a
Meas. Tech.
ChEMBL_532313 (CHEMBL973236)
IC50
159000±n/a nM
Citation
 Jacobsson, M; Gäredal, M; Schultz, J; Karlén, A Identification of Plasmodium falciparum spermidine synthase active site binders through structure-based virtual screening. J Med Chem 51:2777-86 (2008) [PubMed]  Article 
Target
Name:
Spermidine synthase
Synonyms:
n/a
Type:
PROTEIN
Mol. Mass.:
36599.08
Organism:
Plasmodium falciparum
Description:
ChEMBL_532313
Residue:
321
Sequence:
MDKLISNNKLKLSVVLLGGLCSLAYYHLKNKFHLSQFCFSKKWFSEFSIMWPGQAFSVEIKKILYETKSKYQNVLVFESTTYGKVLVLDGVIQLTEKDEFAYHEMMTHIPMTVSKEPKNVLVVGGGDGGIIRELCKYKSVENIDICEIDETVIEVSKIYFKNISCGYEDKRVNVFIEDASKFLENVTNTYDVIIVDSSDPIGPAETLFNQNFYEKIYNALKPNGYCVAQCESLWIHVGTIKNMIGYAKKLFKKVEYANISIPTYPCGCIGILCCSKTDTGLTKPNKKLESKEFADLKYYNYENHSAAFKLPAFLLKEIENI
  
Inhibitor
Name:
BDBM22111
Synonyms:
(2R,3R,4S,5S)-2-(6-amino-9H-purin-9-yl)-5-[(methylsulfanyl)methyl]oxolane-3,4-diol | (2R,3R,4S,5S)-2-(6-aminopurin-9-yl)-5-(methylsulfanylmethyl)oxolane-3,4-diol | 5'-Methylthioado | 5-methylthioadenosine | CHEMBL277041 | MTA
Type:
Nucleoside or nucleotide
Emp. Form.:
C11H15N5O3S
Mol. Mass.:
297.334
SMILES:
CSC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12
Structure:
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