7ZZE

Crystal structure of NAD kinase 1 from Listeria monocytogenes in complex with a linear di-adenosine derivative

Summary for 7ZZE

• Entry DOI: 10.2210/pdb7zze/pdb
• Related: 7ZZ7
• Descriptor: NAD kinase 1, CITRIC ACID, (1~{R},25~{R},26~{S},27~{R})-14-[[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl]-7-azanyl-26,27-bis(oxidanyl)-28-oxa-2,4,6,9,14,17,21,23-octazatetracyclo[23.2.1.0^{2,10}.0^{3,8}]octacosa-3(8),4,6,9-tetraen-11-yne-16,22-dione, ... (4 entities in total)
• Functional Keywords: tetrameric nad-kinase, transferase
• Biological source: Listeria monocytogenes EGD-e
• Total number of polymer chains: 1
• Total formula weight: 31946.09

Authors

Gelin, M.,Labesse, G. (deposition date: 2022-05-25, release date: 2023-01-11, Last modification date: 2024-02-07)

• Primary citation: Clement, D.A.,Gelin, M.,Leseigneur, C.,Huteau, V.,Mondange, L.,Pons, J.L.,Dussurget, O.,Lionne, C.,Labesse, G.,Pochet, S.; Synthesis and structure-activity relationship studies of original cyclic diadenosine derivatives as nanomolar inhibitors of NAD kinase from pathogenic bacteria.; Eur.J.Med.Chem., 246:114941-114941, 2023; PubMed: 36455355; DOI: 10.1016/j.ejmech.2022.114941

Experimental method

X-RAY DIFFRACTION (1.78 Å)