Reaction Details Report a problem with these data
Target
2-dehydro-3-deoxyphosphooctonate aldolase
Ligand
BDBM50362546
Substrate
n/a
Meas. Tech.
ChEMBL_797884 (CHEMBL1942571)
Ki
7900±n/a nM
Citation
 Harrison, AN; Reichau, S; Parker, EJ Synthesis and evaluation of tetrahedral intermediate mimic inhibitors of 3-deoxy-d-manno-octulosonate 8-phosphate synthase. Bioorg Med Chem Lett 22:907-11 (2012) [PubMed]  Article 
Target
Name:
2-dehydro-3-deoxyphosphooctonate aldolase
Synonyms:
3-deoxy-D-manno-octulosonic acid 8-phosphate synthase | KDO 8-P synthase | KDO-8-phosphate synthase | KDOPS | KDSA_NEIMB | Phospho-2-dehydro-3-deoxyoctonate aldolase | kdsA
Type:
PROTEIN
Mol. Mass.:
30484.01
Organism:
Neisseria meningitidis serogroup B (strain MC58)
Description:
ChEMBL_797884
Residue:
280
Sequence:
MDIKINDITLGNNSPFVLFGGINVLESLDSTLQTCAHYVEVTRKLGIPYIFKASFDKANRSSIHSYRGVGLEEGLKIFEKVKAEFGIPVITDVHEPHQCQPVAEVCDVIQLPAFLARQTDLVVAMAKTGNVVNIKKPQFLSPSQMKNIVEKFHEAGNGKLILCERGSSFGYDNLVVDMLGFGVMKQTCGNLPVIFDVTHSLQTRDAGSAASGGRRAQALDLALAGMATRLAGLFLESHPDPKLAKCDGPSALPLHLLEDFLIRIKALDDLIKSQPILTIE
  
Inhibitor
Name:
BDBM50362546
Synonyms:
CHEMBL1938424
Type:
Small organic molecule
Emp. Form.:
C8H18O10P2
Mol. Mass.:
336.17
SMILES:
OC(=O)C(CCCCCCOP(O)(O)=O)OP(O)(O)=O
Structure:
Search PDB for entries with ligand similarity: