Reaction Details  Report a problem with these data
Target
Luciferin 4-monooxygenase
Ligand
BDBM50293119
Substrate
n/a
Meas. Tech.
ChEMBL_514917 (CHEMBL972643)
IC50
2400±n/a nM
Citation
 Auld, DS; Zhang, YQ; Southall, NT; Rai, G; Landsman, M; MacLure, J; Langevin, D; Thomas, CJ; Austin, CP; Inglese, J A basis for reduced chemical library inhibition of firefly luciferase obtained from directed evolution. J Med Chem 52:1450-8 (2010) [PubMed]  Article
Target
Name:
Luciferin 4-monooxygenase
Synonyms:
LUCI_PHOPE
Type:
PROTEIN
Mol. Mass.:
60658.88
Organism:
Photuris pennsylvanica
Description:
ChEMBL_514919
Residue:
545
Sequence:
MEDKNILYGPEPFHPLADGTAGEQMFYALSRYADISGCIALTNAHTKENVLYEEFLKLSCRLAESFKKYGLKQNDTIAVCSENGLQFFLPLIASLYLGIIAAPVSDKYIERELIHSLGIVKPRIIFCSKNTFQKVLNVKSKLKYVETIIILDLNEDLGGYQCLNNFISQNSDINLDVKKFKPNSFNRDDQVALVMFSSGTTGVSKGVMLTHKNIVARFSHCKDPTFGNAINPTTAILTVIPFHHGFGMTTTLGYFTCGFRVALMHTFEEKLFLQSLQDYKVESTLLVPTLMAFFPKSALVEKYDLSHLKEIASGGAPLSKEIGEMVKKRFKLNFVRQGYGLTETTSAVLITPDTDVRPGSTGKIVPFHAVKVVDPTTGKILGPNETGELYFKGDMIMKSYYNNEEATKAIINKDGWLRSGDIAYYDNDGHFYIVDRLKSLIKYKGYQVAPAEIEGILLQHPYIVDAGVTGIPDEAAGELPAAGVVVQTGKYLNEQIVQNFVSSQVSTAKWLRGGVKFLDEIPKGSTGKIDRKVLRQMFEKHKSKL
  
Inhibitor
Name:
BDBM50293119
Synonyms:
5-(furan-2-yl)-3-(pyridin-4-yl)-1,2,4-oxadiazole | CHEMBL472931
Type:
Small organic molecule
Emp. Form.:
C11H7N3O2
Mol. Mass.:
213.1922
SMILES:
c1coc(c1)-c1nc(no1)-c1ccncc1
Structure:
Search PDB for entries with ligand similarity: