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3IS9

Crystal structure of the HIV-1 reverse transcriptase (RT) in complex with the alkenyldiarylmethane (ADAM) Non-nucleoside RT Inhibitor dimethyl 3,3'-(6-methoxy-6-oxohex-1-ene-1,1-diyl)bis(5-cyano-6-methoxybenzoate).

Summary for 3IS9
Entry DOI10.2210/pdb3is9/pdb
Related3IRX
DescriptorReverse transcriptase/ribonuclease H, Reverse transcriptase, dimethyl 3,3'-(6-methoxy-6-oxohex-1-ene-1,1-diyl)bis(5-cyano-6-methoxybenzoate), ... (4 entities in total)
Functional Keywordsnnrti, nonnucleoside inhibitor, aids, hiv, p51/p66, adam, aspartyl protease, cell membrane, cytoplasm, dna integration, dna recombination, dna-directed dna polymerase, endonuclease, hydrolase, lipoprotein, membrane, metal-binding, multifunctional enzyme, myristate, nuclease, nucleotidyltransferase, nucleus, phosphoprotein, protease, rna-binding, rna-directed dna polymerase, transferase, viral nucleoprotein, virion, zinc, zinc-finger, transferase-hydrolase complex, transferase/hydrolase
Biological sourceHuman immunodeficiency virus type 1 BH10 (HIV-1)
More
Cellular locationMatrix protein p17: Virion (Potential). Capsid protein p24: Virion (Potential). Nucleocapsid protein p7: Virion (Potential). Reverse transcriptase/ribonuclease H: Virion (Potential). Integrase: Virion (Potential): P03366 P03366
Total number of polymer chains2
Total formula weight114592.28
Authors
Ho, W.C.,Bauman, J.D.,Das, K.,Arnold, E. (deposition date: 2009-08-25, release date: 2010-04-07, Last modification date: 2023-09-06)
Primary citationCullen, M.D.,Ho, W.C.,Bauman, J.D.,Das, K.,Arnold, E.,Hartman, T.L.,Watson, K.M.,Buckheit, R.W.,Pannecouque, C.,De Clercq, E.,Cushman, M.
Crystallographic study of a novel subnanomolar inhibitor provides insight on the binding interactions of alkenyldiarylmethanes with human immunodeficiency virus-1 reverse transcriptase.
J.Med.Chem., 52:6467-6473, 2009
Cited by
PubMed: 19775161
DOI: 10.1021/jm901167t
PDB entries with the same primary citation
Experimental method
X-RAY DIFFRACTION (2.55 Å)
Structure validation

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