9CCC

Crystal structure of human dihydroorotate dehydrogenase with new alkyne ligand

This is a non-PDB format compatible entry.

Summary for 9CCC

• Entry DOI: 10.2210/pdb9ccc/pdb
• Descriptor: Dihydroorotate dehydrogenase (quinone), mitochondrial, OROTIC ACID, N-{4-[(3-aminophenyl)ethynyl]phenyl}acetamide, ... (8 entities in total)
• Functional Keywords: human dhodh, inhibitor, antiviral, alkyne, oxidoreductase
• Biological source: Homo sapiens (human)
• Total number of polymer chains: 1
• Total formula weight: 41310.21

Authors

Purificacao, A.D.,Andrade, C.H.,Emery, F.S.,Nonato, M.C. (deposition date: 2024-06-21, release date: 2025-06-25)

• Primary citation: Purificacao, A.D.,Vaidergorn, M.M.,Silva-Mendonca, S.,Silva, W.J.L.,Leite, P.I.P.,Santos, T.,Andrade, C.H.,Nonato, M.C.,Emery, F.S.; Discovery of a novel alkyne-based scaffold inhibitor for human DHODH.; To Be Published,

Experimental method

X-RAY DIFFRACTION (2 Å)