Summary for 6CHH
Entry DOI | 10.2210/pdb6chh/pdb |
Descriptor | Nicotinamide N-methyltransferase, (2~{S})-5-[2-(3-aminocarbonylphenyl)ethyl-[[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl]amino]-2-azanyl-pentanoic acid, 1,2-ETHANEDIOL, ... (4 entities in total) |
Functional Keywords | protein-small molecule bisubstrate inhibitor complex, transferase, transferase-transferase inhibitor complex, transferase/transferase inhibitor |
Biological source | Homo sapiens (Human) |
Total number of polymer chains | 4 |
Total formula weight | 128102.51 |
Authors | Babault, N.,Liu, J.,Jin, J. (deposition date: 2018-02-22, release date: 2018-06-13, Last modification date: 2023-10-04) |
Primary citation | Babault, N.,Allali-Hassani, A.,Li, F.,Fan, J.,Yue, A.,Ju, K.,Liu, F.,Vedadi, M.,Liu, J.,Jin, J. Discovery of Bisubstrate Inhibitors of Nicotinamide N-Methyltransferase (NNMT). J. Med. Chem., 61:1541-1551, 2018 Cited by PubMed: 29320176DOI: 10.1021/acs.jmedchem.7b01422 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (2.3 Å) |
Structure validation
Download full validation report