PDBsum entry 3c6u

Transferase

PDB id: 3c6u

Contents

Protein chains

558 a.a.

404 a.a.

Ligands

M22

Waters ×375

References listed in PDB file

Key reference

• Title: The design and synthesis of diaryl ether second generation HIV-1 non-Nucleoside reverse transcriptase inhibitors (nnrtis) with enhanced potency versus key clinical mutations.
• Authors: T.J.Tucker, S.Saggar, J.T.Sisko, R.M.Tynebor, T.M.Williams, P.J.Felock, J.A.Flynn, M.T.Lai, Y.Liang, G.Mcgaughey, M.Liu, M.Miller, G.Moyer, V.Munshi, R.Perlow-Poehnelt, S.Prasad, R.Sanchez, M.Torrent, J.P.Vacca, B.L.Wan, Y.Yan.
• Ref.: Bioorg Med Chem Lett, 2008, 18, 2959-2966. [DOI no: 10.1016/j.bmcl.2008.03.064]
• PubMed id: 18396399

Abstract

Using a combination of traditional Medicinal Chemistry/SAR analysis, crystallography, and molecular modeling, we have designed and synthesized a series of novel, highly potent NNRTIs that possess broad antiviral activity against a number of key clinical mutations.