9B2H

HIV-1 wild type protease with GRL-072-17A, a substituted tetrahydrofuran derivative based on Darunavir as P2 group

This is a non-PDB format compatible entry.

Summary for 9B2H

• Entry DOI: 10.2210/pdb9b2h/pdb
• Related: 2IEN 3NU3
• Descriptor: Protease, SODIUM ION, CHLORIDE ION, ... (7 entities in total)
• Functional Keywords: aspartic acid protease, hiv-1 protease, darunavir, a substituted tetrahydrofuran derivative inhibitor, viral protein
• Biological source: Human immunodeficiency virus 1
• Total number of polymer chains: 2
• Total formula weight: 22504.11

Authors

Wang, Y.-F.,Agniswamy, J.,Ghosh, A.K.,Weber, I.T. (deposition date: 2024-03-15, release date: 2024-07-24)

• Primary citation: Ghosh, A.K.,Lee, D.,Sharma, A.,Johnson, M.E.,Ghosh, A.K.,Wang, Y.F.,Agniswamy, J.,Amano, M.,Hattori, S.I.,Weber, I.T.,Mitsuya, H.; Design of substituted tetrahydrofuran derivatives for HIV-1 protease inhibitors: synthesis, biological evaluation, and X-ray structural studies.; Org.Biomol.Chem., 2024; PubMed: 38973505; DOI: 10.1039/d4ob00506f

Experimental method

X-RAY DIFFRACTION (1.32 Å)