Reaction Details Report a problem with these data
Target
4,4'-diapophytoene synthase
Ligand
BDBM50268680
Substrate
n/a
Meas. Tech.
ChEMBL_523732 (CHEMBL1007539)
IC50
8±n/a nM
Citation
 Song, Y; Liu, CI; Lin, FY; No, JH; Hensler, M; Liu, YL; Jeng, WY; Low, J; Liu, GY; Nizet, V; Wang, AH; Oldfield, E Inhibition of staphyloxanthin virulence factor biosynthesis in Staphylococcus aureus: in vitro, in vivo, and crystallographic results. J Med Chem 52:3869-80 (2009) [PubMed]  Article 
Target
Name:
4,4'-diapophytoene synthase
Synonyms:
CRTM_STAAU | Dehydrosqualene synthase | crtM
Type:
PROTEIN
Mol. Mass.:
34309.10
Organism:
Staphylococcus aureus
Description:
ChEMBL_1352846
Residue:
287
Sequence:
MTMMDMNFKYCHKIMKKHSKSFSYAFDLLPEDQRKAVWAIYAVCRKIDDSIDVYGDIQFLNQIKEDIQSIEKYPYEYHHFQSDRRIMMALQHVAQHKNIAFQSFYNLIDTVYKDQHFTMFETDAELFGYCYGVAGTVGEVLTPILSDHETHQTYDVARRLGESLQLINILRDVGEDFENERIYFSKQRLKQYEVDIAEVYQNGVNNHYIDLWEYYAAIAEKDFRDVMDQIKVFSIEAQPIIELAARIYIEILDEVRQANYTLHERVFVEKRKKAKLFHEINSKYHRI
  
Inhibitor
Name:
BDBM50268680
Synonyms:
CHEMBL495807 | N-3-(3-phenoxyphenyl)propylphosphonoacetamide
Type:
Small organic molecule
Emp. Form.:
C17H20NO5P
Mol. Mass.:
349.3182
SMILES:
CC(=O)NP(O)(=O)OCCCc1cccc(Oc2ccccc2)c1
Structure:
Search PDB for entries with ligand similarity: