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Target
Penicillin-binding protein 2X
Ligand
BDBM50385267
Substrate
n/a
Meas. Tech.
ChEMBL_822530 (CHEMBL2039463)
IC50
278000±n/a nM
Citation
 Zervosen, A; Bouillez, A; Herman, A; Amoroso, A; Joris, B; Sauvage, E; Charlier, P; Luxen, A Synthesis and evaluation of boronic acids as inhibitors of Penicillin Binding Proteins of classes A, B and C. Bioorg Med Chem 20:3915-24 (2012) [PubMed]  Article 
Target
Name:
Penicillin-binding protein 2X
Synonyms:
PBP-2X | PBP2X | PBPX_STRR6 | pbpX
Type:
PROTEIN
Mol. Mass.:
82337.09
Organism:
Streptococcus pneumoniae R6
Description:
ChEMBL_822530
Residue:
750
Sequence:
MKWTKRVIRYATKNRKSPAENRRRVGKSLSLLSVFVFAIFLVNFAVIIGTGTRFGTDLAKEAKKVHQTTRTVPAKRGTIYDRNGVPIAEDATSYNVYAVIDENYKSATGKILYVEKTQFNKVAEVFHKYLDMEESYVREQLSQPNLKQVSFGAKGNGITYANMMSIKKELEAAEVKGIDFTTSPNRSYPNGQFASSFIGLAQLHENEDGSKSLLGTSGMESSLNSILAGTDGIITYEKDRLGNIVPGTEQVSQRTMDGKDVYTTISSPLQSFMETQMDAFQEKVKGKYMTATLVSAKTGEILATTQRPTFDADTKEGITEDFVWRDILYQSNYEPGSTMKVMMLAAAIDNNTFPGGEVFNSSELKIADATIRDWDVNEGLTGGRMMTFSQGFAHSSNVGMTLLEQKMGDATWLDYLNRFKFGVPTRFGLTDEYAGQLPADNIVNIAQSSFGQGISVTQTQMIRAFTAIANDGVMLEPKFISAIYDPNDQTARKSQKEIVGNPVSKDAASLTRTNMVLVGTDPVYGTMYNHSTGKPTVTVPGQNVALKSGTAQIADEKNGGYLVGLTDYIFSAVSMSPAENPDFILYVTVQQPEHYSGIQLGEFANPILERASAMKDSLNLQTTAKALEQVSQQSPYPMPSVKDISPGDLAEELRRNLVQPIVVGTGTKIKNSSAEEGKNLAPNQQVLILSDKAEEVPDMYGWTKETAETLAKWLNIELEFQGSGSTVQKQDVRANTAIKDIKKITLTLGD
  
Inhibitor
Name:
BDBM50385267
Synonyms:
CHEMBL2035284
Type:
Small organic molecule
Emp. Form.:
C10H14BNO5
Mol. Mass.:
239.033
SMILES:
COc1cccc(OC)c1C(=O)NCB(O)O
Structure:
Search PDB for entries with ligand similarity: