6T37

Pseudomonas aeruginosa RmlA in complex with allosteric inhibitor

Summary for 6T37

• Entry DOI: 10.2210/pdb6t37/pdb
• Descriptor: Glucose-1-phosphate thymidylyltransferase, ~{N}-[6-[3-[4-(aminomethyl)-1,2,3-triazol-1-yl]propylamino]-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-~{N}-methyl-benzenesulfonamide, 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, ... (5 entities in total)
• Functional Keywords: rmla, allostery, thymidylyltransferase, inhibitor, transferase
• Biological source: Pseudomonas aeruginosa
• Total number of polymer chains: 4
• Total formula weight: 137428.96

Authors

Alphey, M.S.,Xiao, G.,Westwood, J.N. (deposition date: 2019-10-10, release date: 2020-08-19, Last modification date: 2024-01-24)

• Primary citation: Xiao, G.,Alphey, M.S.,Tran, F.,Pirrie, L.,Milbeo, P.,Zhou, Y.,Bickel, J.K.,Kempf, O.,Kempf, K.,Naismith, J.H.,Westwood, N.J.; Next generation Glucose-1-phosphate thymidylyltransferase (RmlA) inhibitors: An extended SAR study to direct future design.; Bioorg.Med.Chem., 50:116477-116477, 2021; PubMed: 34757294; DOI: 10.1016/j.bmc.2021.116477

Experimental method

X-RAY DIFFRACTION (2.079 Å)