3AO5

Fragment-based approach to the design of ligands targeting a novel site on HIV-1 integrase

Summary for 3AO5

Entry DOI	10.2210/pdb3ao5/pdb
Related	1bl3 3AO1 3AO2 3AO3 3AO4 3L3U 3OVN
Related PRD ID	PRD_900003
Descriptor	POL polyprotein, beta-D-fructofuranose-(2-1)-alpha-D-glucopyranose, 5-(7-bromo-1,3-benzodioxol-5-yl)-1-methyl-1H-pyrazol-3-amine, ... (7 entities in total)
Functional Keywords	dna integration, aids, integrase, endonuclease, polynucleotidyl transferase, dna binding, viral protein, rnaseh, fragment binding, viral protein-transferase inhibitor complex, viral protein/transferase inhibitor
Biological source	Human immunodeficiency virus 1
Total number of polymer chains	2
Total formula weight	37571.74
Authors	Wielens, J.,Headey, S.J.,Parker, M.W.,Chalmers, D.K.,Scanlon, M.J. (deposition date: 2010-09-21, release date: 2011-03-09, Last modification date: 2023-11-01)
Primary citation	Wielens, J.,Headey, S.J.,Deadman, J.J.,Rhodes, D.I.,Parker, M.W.,Chalmers, D.K.,Scanlon, M.J. Fragment-based design of ligands targeting a novel site on the integrase enzyme of human immunodeficiency virus 1 Chemmedchem, 6:258-261, 2011 Cited by PubMed: 21275048 DOI: 10.1002/cmdc.201000483 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (1.8 Å)

Structure validation