6EDR

Crystal Structure of Human CD38 in Complex with 4'-Thioribose NAD+

Summary for 6EDR

• Entry DOI: 10.2210/pdb6edr/pdb
• Descriptor: ADP-ribosyl cyclase/cyclic ADP-ribose hydrolase 1, [[(2~{R},3~{S},4~{R},5~{R})-5-(3-aminocarbonylpyridin-1-yl)-3,4-bis(oxidanyl)thiolan-2-yl]methoxy-oxidanyl-phosphoryl] [(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl hydrogen phosphate (3 entities in total)
• Functional Keywords: inhibitor, cd38, hydrolase, hydrolase-hydrolase inhibitor complex, hydrolase/hydrolase inhibitor
• Biological source: Homo sapiens (Human)
• Total number of polymer chains: 2
• Total formula weight: 60888.47

Authors

Dai, Z.,Zhang, X.N.,Nasertorabi, F.,Cheng, Q.,Pei, H.,Louie, S.G.,Stevens, C.R.,Zhang, Y. (deposition date: 2018-08-10, release date: 2018-11-21, Last modification date: 2023-10-11)

• Primary citation: Dai, Z.,Zhang, X.N.,Nasertorabi, F.,Cheng, Q.,Pei, H.,Louie, S.G.,Stevens, R.C.,Zhang, Y.; Facile chemoenzymatic synthesis of a novel stable mimic of NAD.; Chem Sci, 9:8337-8342, 2018; PubMed: 30568770; DOI: 10.1039/c8sc03899f

Experimental method

X-RAY DIFFRACTION (2.4 Å)