Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetRNA-directed RNA polymerase
LigandBDBM50537587
Substrate/Competitorn/a
Meas. Tech.ChEMBL_1969960 (CHEMBL4602778)
IC50 6.0±n/a nM
Citation Ganta, NMGedda, GRathnakar, BSatyanarayana, MYamajala, BAhsan, MJJadav, SSBalaraju, T A review on HCV inhibitors: Significance of non-structural polyproteins. Eur J Med Chem164:576-601 (2019) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
RNA-directed RNA polymerase
Name:RNA-directed RNA polymerase
Synonyms:Hepatitis C virus NS5B RNA-dependent RNA polymerase | NS5B protein
Type:Protein
Mol. Mass.:25173.95
Organism:Hepatitis C virus
Description:Q8JXU8
Residue:229
Sequence:
RTEEAIYQCCDLDPQARVAIRSLTERLYVGGPLTNSRGENCGYRRRASGVLTTSCGNTLT
CYIKAQAACRAAGRQDCTMLVCGDDLVVICESAGVQEDAASLRAFTEAMTRYSAPPGDPP
QPEYDLELITSCSSNVSVAHDGAGKRVYYLTRDPTTPLARAAWETARHTPVNSWLGNIIM
FAPTLWVRMIMLTHFFSVLIARDQLEQALDCEIYGACYSIEPLLPPIIQ
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50537587
n/a
NameBDBM50537587
Synonyms:CHEMBL4633142
TypeSmall organic molecule
Emp. Form.C25H21F2N3O5S
Mol. Mass.513.513
SMILESCC1COc2cc3c(c(C(=O)NS(C)(=O)=O)n(Cc4cc(F)ccc4F)c3cc12)-c1ccc[nH]c1=O |(21.41,-24.4,;22.91,-24.06,;23.53,-22.66,;25.05,-22.81,;25.38,-24.31,;26.73,-25.08,;26.73,-26.63,;27.88,-27.65,;27.26,-29.06,;28.03,-30.39,;29.57,-30.39,;27.27,-31.73,;28.04,-33.05,;27.27,-34.4,;29.37,-32.28,;29.38,-33.82,;25.73,-28.9,;24.94,-30.23,;23.4,-30.21,;22.65,-28.87,;21.11,-28.85,;20.36,-27.51,;20.32,-30.18,;21.09,-31.53,;22.63,-31.54,;23.39,-32.88,;25.4,-27.4,;24.06,-26.63,;24.06,-25.08,;29.38,-27.33,;30.41,-28.47,;31.91,-28.15,;32.39,-26.69,;31.36,-25.54,;29.85,-25.86,;28.81,-24.72,)|
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: