6WML

Human TLR8 bound to the potent agonist, GS-9688 (Selgantolimod)

Summary for 6WML

• Entry DOI: 10.2210/pdb6wml/pdb
• Descriptor: Toll-like receptor 8, alpha-D-mannopyranose-(1-6)-beta-D-mannopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, beta-D-mannopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, ... (10 entities in total)
• Functional Keywords: selgantolimod, toll-like receptor, immune activator, receptor agonist, immune system
• Biological source: Homo sapiens (Human)
• Total number of polymer chains: 4
• Total formula weight: 385501.73

Authors

Appleby, T.C.,Perry, J.K.,Mish, M.,Villasenor, A.G.,Mackman, R.L. (deposition date: 2020-04-21, release date: 2021-02-03, Last modification date: 2023-10-18)

• Primary citation: Mackman, R.L.,Mish, M.,Chin, G.,Perry, J.K.,Appleby, T.,Aktoudianakis, V.,Metobo, S.,Pyun, P.,Niu, C.,Daffis, S.,Yu, H.,Zheng, J.,Villasenor, A.G.,Zablocki, J.,Chamberlain, J.,Jin, H.,Lee, G.,Suekawa-Pirrone, K.,Santos, R.,Delaney 4th, W.E.,Fletcher, S.P.; Discovery of GS-9688 (Selgantolimod) as a Potent and Selective Oral Toll-Like Receptor 8 Agonist for the Treatment of Chronic Hepatitis B.; J.Med.Chem., 63:10188-10203, 2020; PubMed: 32407112; DOI: 10.1021/acs.jmedchem.0c00100

Experimental method

X-RAY DIFFRACTION (2.5 Å)