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TargetDecaprenyl diphosphate synthase
LigandBDBM153315
Substrate/Competitorn/a
Meas. Tech.DPPS Inhibition (GPP based) Assay
pH7.5±n/a
IC50 3.6e+2±n/a nM
Commentsextracted
Citation Kim, MOFeng, XFeixas, FZhu, WLindert, SBogue, SSinko, Wde Oliveira, CRao, GOldfield, EMcCammon, JA A Molecular Dynamics Investigation of Mycobacterium tuberculosis Prenyl Synthases: Conformational Flexibility and Implications for Computer-aided Drug Discovery. Chem Biol Drug Des85:756-69 (2015) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Decaprenyl diphosphate synthase
Name:Decaprenyl diphosphate synthase
Synonyms:DPDS_MYCTO | cis-Decaprenyl diphosphate synthase (cis-DPPS) | uppS
Type:Protein
Mol. Mass.:33800.02
Organism:Mycobacterium tuberculosis H37Rv
Description:n/a
Residue:296
Sequence:
MARDARKRTSSNFPQLPPAPDDYPTFPDTSTWPVVFPELPAAPYGGPCRPPQHTSKAAAP
RIPADRLPNHVAIVMDGNGRWATQRGLARTEGHKMGEAVVIDIACGAIELGIKWLSLYAF
STENWKRSPEEVRFLMGFNRDVVRRRRDTLKKLGVRIRWVGSRPRLWRSVINELAVAEEM
TKSNDVITINYCVNYGGRTEITEATREIAREVAAGRLNPERITESTIARHLQRPDIPDVD
LFLRTSGEQRSSNFMLWQAAYAEYIFQDKLWPDYDRRDLWAACEEYASRTRRFGSA
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM153315
n/a
NameBDBM153315
Synonyms:BPH-789
TypeSmall organic molecule
Emp. Form.C34H36N2O18P4S2
Mol. Mass.948.677
SMILESOC(Cc1cccc(c1)-c1cccc(NS(=O)(=O)c2cccc(c2)S(=O)(=O)Nc2cccc(c2)-c2cccc(CC(O)(P(O)(O)=O)P(O)(O)=O)c2)c1)(P(O)(O)=O)P(O)(O)=O
Structure
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