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Targetcis-Decaprenyl diphosphate synthase (cis-DPPS)
LigandBDBM25284
Substrate/Competitorn/a
Meas. Tech.DPPS Inhibition (trans FPP based) Assay
pH7.5±n/a
IC50 8.2e+3± 0 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
 
cis-Decaprenyl diphosphate synthase (cis-DPPS)
Name:cis-Decaprenyl diphosphate synthase (cis-DPPS)
Synonyms:n/a
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:
BDBM25284
NameBDBM25284
Synonyms:(1-hydroxy-2-{3-[3-(naphthalene-2-sulfonamido)phenyl]phenyl}-1-phosphonoethyl)phosphonic acid | BPH-675 | bisphosphonate, 6
TypeSmall organic molecule
Emp. Form.C24H23NO9P2S
Mol. Mass.563.453
SMILESOC(Cc1cccc(c1)-c1cccc(NS(=O)(=O)c2ccc3ccccc3c2)c1)(P(O)(O)=O)P(O)(O)=O
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least:
n/a