7DEN

Crystal structure of P.aeruginosa LpxC in complex with inhibitor

Summary for 7DEN

Entry DOI	10.2210/pdb7den/pdb
Descriptor	UDP-3-O-acyl-N-acetylglucosamine deacetylase, ZINC ION, 4-[(1~{R},5~{S})-6-[2-[4-[3-[[2-[(1~{S})-1-oxidanylethyl]imidazol-1-yl]methyl]-1,2-oxazol-5-yl]phenyl]ethynyl]-3-azabicyclo[3.1.0]hexan-3-yl]butanoic acid, ... (4 entities in total)
Functional Keywords	udp-3-o-acyl-n-acetylglucosamine deacetylase enva, lpxc, pseudomonas aeruginosa, hydrolase
Biological source	Pseudomonas aeruginosa PAO1
Total number of polymer chains	1
Total formula weight	33672.55
Authors	Mima, M.,Ushiyama, F.,Takashima, H. (deposition date: 2020-11-04, release date: 2021-01-13, Last modification date: 2023-11-29)
Primary citation	Ushiyama, F.,Takashima, H.,Matsuda, Y.,Ogata, Y.,Sasamoto, N.,Kurimoto-Tsuruta, R.,Ueki, K.,Tanaka-Yamamoto, N.,Endo, M.,Mima, M.,Fujita, K.,Takata, I.,Tsuji, S.,Yamashita, H.,Okumura, H.,Otake, K.,Sugiyama, H. Lead optimization of 2-hydroxymethyl imidazoles as non-hydroxamate LpxC inhibitors: Discovery of TP0586532. Bioorg.Med.Chem., 30:115964-115964, 2020 Cited by PubMed: 33385955 DOI: 10.1016/j.bmc.2020.115964 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.07 Å)

Structure validation