Reaction Details Report a problem with these data
Target
4,4'-diapophytoene synthase
Ligand
BDBM50268629
Substrate
n/a
Meas. Tech.
ChEMBL_523732 (CHEMBL1007539)
Ki
5700±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:
BDBM50268629
Synonyms:
3-(3-Phenoxyphenyl)propyl Phosphonoacetate Dipotassium Salt | CHEMBL496803
Type:
Small organic molecule
Emp. Form.:
C17H17O6P
Mol. Mass.:
348.2881
SMILES:
[O-]P([O-])(=O)CC(=O)OCCCc1cccc(Oc2ccccc2)c1
Structure:
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