5OEQ

Mycobacterium tuberculosis DprE1 in complex with inhibitor TCA020

Summary for 5OEQ

• Entry DOI: 10.2210/pdb5oeq/pdb
• Related: 4KW5 5OEL 5OEP
• Descriptor: Decaprenylphosphoryl-beta-D-ribose oxidase, FLAVIN-ADENINE DINUCLEOTIDE, ~{N}-[3-(pyrimidin-2-ylcarbamoyl)thiophen-2-yl]-[1,3]thiazolo[4,5-c]pyridine-2-carboxamide, ... (5 entities in total)
• Functional Keywords: fad-containing oxidoreductase decaprenylphosphoarabinose synthesis, oxidoreductase
• Biological source: Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv)
• Total number of polymer chains: 2
• Total formula weight: 106102.29

Authors

Futterer, K.,Batt, S.M.,Besra, G.S. (deposition date: 2017-07-09, release date: 2018-05-16, Last modification date: 2024-01-17)

• Primary citation: Liu, R.,Lyu, X.,Batt, S.M.,Hsu, M.H.,Harbut, M.B.,Vilcheze, C.,Cheng, B.,Ajayi, K.,Yang, B.,Yang, Y.,Guo, H.,Lin, C.,Gan, F.,Wang, C.,Franzblau, S.G.,Jacobs, W.R.,Besra, G.S.,Johnson, E.F.,Petrassi, M.,Chatterjee, A.K.,Futterer, K.,Wang, F.; Determinants of the Inhibition of DprE1 and CYP2C9 by Antitubercular Thiophenes.; Angew. Chem. Int. Ed. Engl., 56:13011-13015, 2017; PubMed: 28815830; DOI: 10.1002/anie.201707324

Experimental method

X-RAY DIFFRACTION (2.25 Å)