8FA0

Crystal structure of clade A/E 93TH057 HIV-1 gp120 core in complex with NBD-14208, an HIV-1 gp120 antagonist

Summary for 8FA0

Entry DOI	10.2210/pdb8fa0/pdb
Descriptor	HIV-1 gp120 core, 2-acetamido-2-deoxy-beta-D-glucopyranose, N-{(1S)-2-amino-1-[4,5-bis(hydroxymethyl)-1,3-thiazol-2-yl]ethyl}-5-(4-chloro-3,5-difluorophenyl)-1H-pyrrole-2-carboxamide, ... (5 entities in total)
Functional Keywords	hiv-1, nbd-14208, small molecules, cd4-gp120 binding inhibitor, antagonist, viral protein
Biological source	Homo sapiens (human)
Total number of polymer chains	1
Total formula weight	42054.07
Authors	Kwon, Y.D.,Kwong, P.D. (deposition date: 2022-11-25, release date: 2023-01-11, Last modification date: 2023-09-20)
Primary citation	Curreli, F.,Kwon, Y.D.,Nicolau, I.,Burgos, G.,Altieri, A.,Kurkin, A.V.,Verardi, R.,Kwong, P.D.,Debnath, A.K. Antiviral Activity and Crystal Structures of HIV-1 gp120 Antagonists. Int J Mol Sci, 23:-, 2022 Cited by PubMed: 36555641 DOI: 10.3390/ijms232415999 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.09 Å)

Structure validation