Entry Database : PDB / ID : 8fuj Structure visualization Downloads & linksTitle HIV-1 wild type protease with GRL-03419A, with N-(2,5-dimethylphenyl)-4-(pyridin-3-yl)pyrimidin-2-amine as P2-P3 group and 3,5-difluorophenylmethyl as the P1 group ComponentsProtease Details Keywords HYDROLASE/INHIBITOR / ASPARTIC ACID PROTEASE / HIV-1 PROTEASE / INHIBITORS / pyridylpyrimidine / HYDROLASE-INHIBITOR complexFunction / homology Function and homology informationFunction Domain/homology Component
Retropepsin-like catalytic domain / Retropepsins / Retroviral aspartyl protease / Aspartyl protease, retroviral-type family profile. / Peptidase A2A, retrovirus, catalytic / Aspartic peptidase, active site / Eukaryotic and viral aspartyl proteases active site. / Aspartic peptidase domain superfamily Similarity search - Domain/homologyBiological species Human immunodeficiency virus 1Method X-RAY DIFFRACTION / SYNCHROTRON / MOLECULAR REPLACEMENT / Resolution : 1.12 Å DetailsAuthors Wang, Y.-F. / Agniswamy, J. / Ghosh, A.K. / Weber, I.T. Funding support United States, 2items Details Hide detailsOrganization Grant number Country National Institutes of Health/National Institute Of Allergy and Infectious Diseases (NIH/NIAID) AI150466 United States National Institutes of Health/National Institute Of Allergy and Infectious Diseases (NIH/NIAID) AI150461 United States
CitationJournal : Eur.J.Med.Chem. / Year : 2023Title : Exploration of imatinib and nilotinib-derived templates as the P2-Ligand for HIV-1 protease inhibitors: Design, synthesis, protein X-ray structural studies, and biological evaluation.Authors : Ghosh, A.K. / Mishevich, J.L. / Kovela, S. / Shaktah, R. / Ghosh, A.K. / Johnson, M. / Wang, Y.F. / Wong-Sam, A. / Agniswamy, J. / Amano, M. / Takamatsu, Y. / Hattori, S.I. / Weber, I.T. / Mitsuya, H. History Deposition Jan 17, 2023 Deposition site : RCSB / Processing site : RCSBRevision 1.0 May 24, 2023 Provider : repository / Type : Initial releaseRevision 1.1 May 22, 2024 Group : Data collection / Category : chem_comp_atom / chem_comp_bond
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