Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetReverse transcriptase protein
LigandBDBM27580
Substrate/Competitorn/a
Meas. Tech.ChEMBL_756683 (CHEMBL1805148)
IC50 300±n/a nM
Citation Butini, SGemma, SBrindisi, MBorrelli, GFiorini, ISamuele, AKarytinos, AFacchini, MLossani, AZanoli, SCampiani, GNovellino, EFocher, FMaga, G Enantioselective binding of second generation pyrrolobenzoxazepinones to the catalytic ternary complex of HIV-1 RT wild-type and L100I and K103N drug resistant mutants. Bioorg Med Chem Lett21:3935-8 (2011) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Reverse transcriptase protein
Name:Reverse transcriptase protein
Synonyms:Reverse Transcriptase | Reverse Transcriptase (A62V) | Reverse Transcriptase (F61A)
Type:Protein
Mol. Mass.:30203.56
Organism:Human immunodeficiency virus 1
Description:Q9WJQ2
Residue:259
Sequence:
PISPIEPVPVKLKPGMDGPKVKQWPLTEEKIKALVEICTEMEKEGKISKIGPENPYNTPV
FAIKKKDSTRWRKLVDFRELNKRTQDFWEVQLGIPHPAGLKKKRSVTVLDVGDAYFSVPL
DKEFRKYTAFTIPSINNETPGIRYQYNVLPQGWKGSPAIFQSSMTKILEPFRKQNPDIVI
YQYMDDLYVGSDLEIGQHRTKIEELRQHLLKWGFTTPDKKHQKEPPFLWMGYEHHPDKWT
VQPIVLPEKDSWTVNDIQK
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM27580
n/a
NameBDBM27580
Synonyms:8-[4-(3-chlorophenoxymethyl)phenyl]-8-ethyl-9-oxa-2-azatricyclo[8.4.0.0^{2,6}]tetradeca-1(14),3,5,10,12-pentaen-7-one | Pyrrolobenzoxazepinone (PBO), 5
TypeSmall organic molecule
Emp. Form.C27H22ClNO3
Mol. Mass.443.921
SMILESCCC1(Oc2ccccc2-n2cccc2C1=O)c1ccc(COc2cccc(Cl)c2)cc1
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: