4WEL
Crystal structure of Pseudomonas aeruginosa PBP3 with SMC-3176
Summary for 4WEL
Entry DOI | 10.2210/pdb4wel/pdb |
Related | 4WEJ 4WEK |
Descriptor | Penicillin-binding protein 3, (3S,4S,7Z)-7-(2-amino-1,3-thiazol-4-yl)-4-formyl-1-[({3-(5-hydroxy-4-oxo-3,4-dihydropyridin-2-yl)-4-[3-(methylsulfonyl)propyl]-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl}sulfonyl)amino]-3,10,10-trimethyl-1,6-dioxo-9-oxa-2,5,8-triazaundec-7-en-11-oic acid (3 entities in total) |
Functional Keywords | inhibitor, siderophore-conjugated monocarbams, pseudomonas aeruginosa, penicillin-binding protein 3, penicillin-binding protein-inhibitor complex, penicillin-binding protein/inhibitor |
Biological source | Pseudomonas aeruginosa PA14 |
Total number of polymer chains | 1 |
Total formula weight | 59106.23 |
Authors | Ferguson, A.D. (deposition date: 2014-09-10, release date: 2015-04-22, Last modification date: 2023-09-27) |
Primary citation | Murphy-Benenato, K.E.,Dangel, B.,Davis, H.E.,Durand-Reville, T.F.,Ferguson, A.D.,Gao, N.,Jahic, H.,Mueller, J.P.,Manyak, E.L.,Quiroga, O.,Rooney, M.,Sha, L.,Sylvester, M.,Wu, F.,Zambrowski, M.,Zhao, S.X. SAR and Structural Analysis of Siderophore-Conjugated Monocarbam Inhibitors of Pseudomonas aeruginosa PBP3. Acs Med.Chem.Lett., 6:537-542, 2015 Cited by PubMed: 26005529DOI: 10.1021/acsmedchemlett.5b00026 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (1.99 Å) |
Structure validation
Download full validation report