7GP6

PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3C Protease in complex with Z53116498

Summary for 7GP6

• Entry DOI: 10.2210/pdb7gp6/pdb
• Group deposition: PanDDA analysis group deposition (G_1002271)
• Descriptor: Protease 3C, 3-(2-methyl-1H-benzimidazol-1-yl)propanamide, DIMETHYL SULFOXIDE, ... (4 entities in total)
• Functional Keywords: diamond i04-1 fragment screening, pandda, xchemexplorer, xce, viral protease, 3c, viral protein
• Biological source: Human Enterovirus D68
• Total number of polymer chains: 2
• Total formula weight: 40533.39

Authors

Lithgo, R.M.,Fairhead, M.,Koekemoer, L.,Aschenbrenner, J.C.,Balcomb, B.H.,Godoy, A.S.,Marples, P.G.,Ni, X.,Tomlinson, C.W.E.,Thompson, W.,Wild, C.,Fearon, D.,Walsh, M.A.,von Delft, F. (deposition date: 2023-08-24, release date: 2023-11-29, Last modification date: 2024-10-16)

• Primary citation: Lithgo, R.M.,Tomlinson, C.W.E.,Fairhead, M.,Winokan, M.,Thompson, W.,Wild, C.,Aschenbrenner, J.C.,Balcomb, B.H.,Marples, P.G.,Chandran, A.V.,Golding, M.,Koekemoer, L.,Williams, E.P.,Wang, S.,Ni, X.,MacLean, E.,Giroud, C.,Godoy, A.S.,Xavier, M.A.,Walsh, M.,Fearon, D.,von Delft, F.; Crystallographic Fragment Screen of Coxsackievirus A16 2A Protease identifies new opportunities for the development of broad-spectrum anti-enterovirals.; Biorxiv, 2024; PubMed: 38746446; DOI: 10.1101/2024.04.29.591684

Experimental method

X-RAY DIFFRACTION (1.73 Å)