Reaction Details Report a problem with these data
Target
PBP2A
Ligand
BDBM50213269
Substrate
n/a
Meas. Tech.
ChEMBL_153662 (CHEMBL757854)
IC50
2.76e+03±n/a nM
Citation
  TBA Bioorg Med Chem Lett 5:1427-1432 (1995)   
Target
Name:
PBP2A
Synonyms:
MecA PBP2' (penicillin binding protein 2') | PBP2A | Penicillin-binding protein | mecA
Type:
PROTEIN
Mol. Mass.:
76283.66
Organism:
Staphylococcus aureus
Description:
ChEMBL_105733
Residue:
668
Sequence:
MKKIKIVPLILIVVVVGFGIYFYASKDKEINNTIDAIEDKNFKQVYKDSSYISKSDNGEVEMTERPIKIYNSLGVKDINIQDRKIKKVSKNKKRVDAQYKIKTNYGNIDRNVQFNFVKEDGMWKLDWDHSVIIPGMQKDQSIHIENLKSERGKILDRNNVELANTGTHMRLGIVPKNVSKKDYKAIAKELSISEDYINNKWIKIGYKMIPSFHFKTVKKMDEYLSDFAKKFHLTTNETESRNYPLEKATSHLLGYVGPINSEELKQKEYKGYKDDAVIGKKGLEKLYDKKLQHEDGYRVTIVDDNSNTIAHTLIEKKKKDGKDIQLTIDAKVQKSIYNNMKNDYGSGTAIHPQTGELLALVSTPSYDVYPFMYGMSNEEYNKLTEDKKEPLLNKFQITTSPGSTQKILTAMIGLNNKTLDDKTSYKIDGKGWQKDKSWGGYNVTRYEVVNGNIDLKQAIESSDNIFFARVALELGSKKFEKGMKKLGVGEDIPSDYPFYNAQISNKNLDNEILLADSGYGQGEILINPVQILSIYSALENNGNINAPHLLKDTKNKVWKKNIISKENINLLNDGMQQVVNKTHKEDIYRSYANLIGKSGTAELKMKQGESGRQIGWFISYDKDNPNMMMAINVKDVQDKGMASYNAKISGKVYDELYENGNKKYDIDE
  
Inhibitor
Name:
BDBM50213269
Synonyms:
CHEMBL430721
Type:
Small organic molecule
Emp. Form.:
C16H15N2NaO5S3
Mol. Mass.:
434.485
SMILES:
[Na+].[H][C@]12[C@@H](C)C(Sc3nc4c(CO)csc4s3)=C(N1C(=O)[C@]2([H])[C@@H](C)O)C([O-])=O |c:17|
Structure:
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