Reaction Details Report a problem with these data
Target
Isocitrate lyase
Ligand
BDBM50480795
Substrate
n/a
Meas. Tech.
ChEMBL_587468 (CHEMBL1042189)
IC50
51200±n/a nM
Citation
 Song, J; Jeong, W; Wang, N; Lee, HS; Sim, CJ; Oh, KB; Shin, J Scalarane sesterterpenes from the sponge Smenospongia sp. J Nat Prod 71:1866-71 (2008) [PubMed]  Article 
Target
Name:
Isocitrate lyase
Synonyms:
ACEA_MAGO7 | ICL | ICL1 | Isocitrase | Isocitratase
Type:
PROTEIN
Mol. Mass.:
61002.51
Organism:
Magnaporthe oryzae (strain 70-15 / FGSC 8958) (Rice blast fungus)(Pyricularia oryzae)
Description:
ChEMBL_438441
Residue:
547
Sequence:
MASKNMVNPAVEPSMEDDLFAREVAEVKQWWSDPRWRYTKRPFTAEQIVSKRGNLKIEYPSNAQSKKLWKILEGRFQKRDASYTYGCLEPTMVTQMAKYLDTVYVSGWQSSSTASSSDEPGPDLADYPYTTVPNKVSHLFMAQLFHDRKQRHERLSAPKSERSKLQNIDYLRPIIADADTGHGGLTAVMKLTKLFIEKGAAGIHIEDQAPGTKKCGHMAGKVLVPISEHINRLVAIRAQADIMGVDLLAIARTDAEAATLITTSIDPRDHAFILGCTNPSLQPLADLMNTAEQSGKTGDQLQAIEDEWMAKANLKRFDDAVVDVINSSSSIRNPKDVAAKYLQAAKGKSNREARAIASSLGVPEIFFDWDSPRTREGYFRIKGGCDCAINRAIAYAPYADAIWMESKLPDYEQAKEFAEGVHAVYPEQKLAYNLSPSFNWKTAMPRDEQETYIRRLAGLGYCWQFITLAGLHTTALISDRFARAYSEVGMRAYGELVQEPEMELGVDVVKHQKWSGATYVDELQKMVTGGVSSTAAMGKGVTEDQFH
  
Inhibitor
Name:
BDBM50480795
Synonyms:
3-Nitroporpionic Acid | 3-Nitropropionate | 3-Nitropropionic Acid | CHEBI:16348 | CHEMBL451226
Type:
Small organic molecule
Emp. Form.:
C3H5NO4
Mol. Mass.:
119.0761
SMILES:
OC(=O)CC[N+]([O-])=O
Structure:
Search PDB for entries with ligand similarity: