3I6O

Crystal structure of wild type HIV-1 protease with macrocyclic inhibitor GRL-0216A

Summary for 3I6O

Entry DOI	10.2210/pdb3i6o/pdb
Related	2HB3 2IEN 2Z4O 3DJK 3DK1 3H5B
Descriptor	Protease, SODIUM ION, IODIDE ION, ... (6 entities in total)
Functional Keywords	hiv-1, wild type protease, protease inhibitor, macrocyclic ligand, aids, aspartyl protease, hydrolase
Biological source	Human immunodeficiency virus type 1 (BRU ISOLATE) (HIV-1)
Cellular location	Gag-Pol polyprotein: Host cell membrane ; Lipid-anchor. Matrix protein p17: Virion membrane; Lipid- anchor . Capsid protein p24: Virion . Nucleocapsid protein p7: Virion . Reverse transcriptase/ribonuclease H: Virion . Integrase: Virion : P03367
Total number of polymer chains	2
Total formula weight	24753.45
Authors	Chumanevich, A.A.,Wang, Y.-F.,Kovalevsky, A.Y.,Weber, I.T. (deposition date: 2009-07-07, release date: 2009-09-29, Last modification date: 2023-09-06)
Primary citation	Ghosh, A.K.,Kulkarni, S.,Anderson, D.D.,Hong, L.,Baldridge, A.,Wang, Y.F.,Chumanevich, A.A.,Kovalevsky, A.Y.,Tojo, Y.,Amano, M.,Koh, Y.,Tang, J.,Weber, I.T.,Mitsuya, H. Design, Synthesis, Protein-Ligand X-ray Structure, and Biological Evaluation of a Series of Novel Macrocyclic Human Immunodeficiency Virus-1 Protease Inhibitors to Combat Drug Resistance. J.Med.Chem., 52:7689-7705, 2009 Cited by PubMed: 19746963 DOI: 10.1021/jm900695w PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (1.17 Å)

Structure validation