5N8C

Crystal structure of Pseudomonas aeruginosa LpxC complexed with inhibitor

Summary for 5N8C

• Entry DOI: 10.2210/pdb5n8c/pdb
• Descriptor: UDP-3-O-acyl-N-acetylglucosamine deacetylase, ZINC ION, (2~{S})-3-azanyl-2-[[(1~{R})-5-[2-[4-[[2-(hydroxymethyl)imidazol-1-yl]methyl]phenyl]ethynyl]-2,3-dihydro-1~{H}-inden-1-yl]amino]-3-methyl-~{N}-oxidanyl-butanamide, ... (5 entities in total)
• Functional Keywords: inhibitor, lpxc, hyroxamate, antibacterial, hydrolase
• Biological source: Pseudomonas aeruginosa
• Total number of polymer chains: 2
• Total formula weight: 68371.80

Authors

Cross, J.B.,Ryan, M.D.,Zhang, J.,Cheng, R.K.,Wood, M.,Andersen, O.A.,Brooks, M.,Kwong, J.,Barker, J. (deposition date: 2017-02-23, release date: 2017-03-29, Last modification date: 2024-01-17)

• Primary citation: Zhang, J.,Chan, A.,Lippa, B.,Cross, J.B.,Liu, C.,Yin, N.,Romero, J.A.,Lawrence, J.,Heney, R.,Herradura, P.,Goss, J.,Clark, C.,Abel, C.,Zhang, Y.,Poutsiaka, K.M.,Epie, F.,Conrad, M.,Mahamoon, A.,Nguyen, K.,Chavan, A.,Clark, E.,Li, T.C.,Cheng, R.K.,Wood, M.,Andersen, O.A.,Brooks, M.,Kwong, J.,Barker, J.,Parr, I.B.,Gu, Y.,Ryan, M.D.,Coleman, S.,Metcalf, C.A.; Structure-based discovery of LpxC inhibitors.; Bioorg. Med. Chem. Lett., 27:1670-1680, 2017; PubMed: 28302397; DOI: 10.1016/j.bmcl.2017.03.006

Experimental method

X-RAY DIFFRACTION (1.9 Å)