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1T7I

The structural and thermodynamic basis for the binding of TMC114, a next-generation HIV-1 protease inhibitor.

Summary for 1T7I
Entry DOI10.2210/pdb1t7i/pdb
Related1F7A 1T3R
DescriptorPol Polyprotein, PHOSPHATE ION, ACETATE ION, ... (5 entities in total)
Functional Keywordshiv-1 protease, drug resitance, thermodynamics, substrate envelope, hydrolase
Biological sourceHuman immunodeficiency virus 1
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): P35963
Total number of polymer chains2
Total formula weight22709.14
Authors
King, N.M.,Prabu-Jeyabalan, M.,Nalivaika, E.A.,Wigerinck, P.B.T.P.,De Bethune, M.-P.,Schiffer, C.A. (deposition date: 2004-05-10, release date: 2005-05-10, Last modification date: 2023-08-23)
Primary citationSurleraux, D.L.N.G.,Tahri, A.,Verschueren, W.G.,Pille, G.M.E.,de Kock, H.A.,Jonckers, T.H.M.,Peeters, A.,De Meyer, S.,Azijn, H.,Pauwels, R.,de Bethune, M.-P.,King, N.M.,Prabu-Jeyabalan, M.,Schiffer, C.A.,Wigerinck, P.B.T.P.
Discovery and selection of TMC114, a next generation HIV-1 protease inhibitor
J.Med.Chem., 48:1813-1822, 2005
Cited by
PubMed: 15771427
DOI: 10.1021/jm049560p
PDB entries with the same primary citation
Experimental method
X-RAY DIFFRACTION (1.35 Å)
Structure validation

217705

数据于2024-03-27公开中

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