8RIB

N-terminal domain of Trypanosoma brucei PEX14 in complex with a pyrazolo-pyrazolo[4,3-c]pyridin-3-yl compound showing a novel binding pose

Summary for 8RIB

• Entry DOI: 10.2210/pdb8rib/pdb
• Descriptor: Peroxisomal membrane protein PEX14, 1-(2-azanylethyl)-5-[(4-methoxynaphthalen-1-yl)methyl]-~{N}-[(4-methylsulfanylphenyl)methyl]-6,7-dihydro-4~{H}-pyrazolo[4,3-c]pyridine-3-carboxamide, 1,2-ETHANEDIOL, ... (7 entities in total)
• Functional Keywords: structure-based drug discovery, complex, inhibitor, trypanosomiasis, signaling protein
• Biological source: Trypanosoma brucei brucei
• Total number of polymer chains: 2
• Total formula weight: 17800.76

Authors

Napolitano, V.,Janna Olmos, J.,Popowicz, G.M.,Dubin, G. (deposition date: 2023-12-18, release date: 2025-01-29)

• Primary citation: Menezes, F.,Napolitano, V.,Frohlich, T.,Rioton, S.,Janna Olmos, J.D.,Dubin, G.,Popowicz, G.M.; Quantum Chemistry in a Pocket; To Be Published,

Experimental method

X-RAY DIFFRACTION (1.126 Å)