Reaction Details Report a problem with these data
Target
Cytochrome P450 1B1
Ligand
BDBM50045924
Substrate
n/a
Meas. Tech.
EROD Assay
pH
8±0
Temperature
310.15±0 K
Ki
74.3±n/a nM
Km
158±0 nM
Citation
 Katsuyama, Y; Funa, N; Miyahisa, I; Horinouchi, S Synthesis of unnatural flavonoids and stilbenes by exploiting the plant biosynthetic pathway in Escherichia coli. Chem Biol 14:613-21 (2007) [PubMed]  Article 
Target
Name:
Cytochrome P450 1B1
Synonyms:
CP1B1_HUMAN | CYP1B1 | CYPIB1 | Cytochrome P450 1B1 (CYP1B1)
Type:
PROTEIN
Mol. Mass.:
60861.81
Organism:
Homo sapiens (Human)
Description:
ChEMBL_1474523
Residue:
543
Sequence:
MGTSLSPNDPWPLNPLSIQQTTLLLLLSVLATVHVGQRLLRQRRRQLRSAPPGPFAWPLIGNAAAVGQAAHLSFARLARRYGDVFQIRLGSCPIVVLNGERAIHQALVQQGSAFADRPAFASFRVVSGGRSMAFGHYSEHWKVQRRAAHSMMRNFFTRQPRSRQVLEGHVLSEARELVALLVRGSADGAFLDPRPLTVVAVANVMSAVCFGCRYSHDDPEFRELLSHNEEFGRTVGAGSLVDVMPWLQYFPNPVRTVFREFEQLNRNFSNFILDKFLRHCESLRPGAAPRDMMDAFILSAEKKAAGDSHGGGARLDLENVPATITDIFGASQDTLSTALQWLLLLFTRYPDVQTRVQAELDQVVGRDRLPCMGDQPNLPYVLAFLYEAMRFSSFVPVTIPHATTANTSVLGYHIPKDTVVFVNQWSVNHDPLKWPNPENFDPARFLDKDGLINKDLTSRVMIFSVGKRRCIGEELSKMQLFLFISILAHQCDFRANPNEPAKMNFSYGLTIKPKSFKVNVTLRESMELLDSAVQNLQAKETCQ
  
Inhibitor
Name:
BDBM50045924
Synonyms:
(E)-3,5-stilbenediol | (E)-5-(2-phenylethenyl)-1,3-benzenediol | 5-[(1E)-2-phenylethenyl]benzene-1,3-diol | 5-[(E)-2-phenylvinyl]benzene-1,3-diol | CHEMBL101506 | Stilbene, 1f | pinosylvine | trans-3,5-dihydroxystilbene | trans-pinosylvin
Type:
Small organic molecule
Emp. Form.:
C14H12O2
Mol. Mass.:
212.2439
SMILES:
Oc1cc(O)cc(\C=C\c2ccccc2)c1
Structure:
Search PDB for entries with ligand similarity: