5C83
Fragment-Based Drug Discovery Targeting Inhibitor of Apoptosis Proteins: Compound 21
Summary for 5C83
Entry DOI | 10.2210/pdb5c83/pdb |
Related | 5C0K 5C0L 5C3C 5C3H 5C3K 5C7A 5C7B 5C7D |
Descriptor | E3 ubiquitin-protein ligase XIAP, ZINC ION, (2R,5R)-4-[2-(6-benzyl-3,3-dimethyl-2,3-dihydro-1H-pyrrolo[3,2-c]pyridin-1-yl)-2-oxoethyl]-5-(methoxymethyl)-2-methylpiperazin-1-ium, ... (4 entities in total) |
Functional Keywords | ligase, apoptosis |
Biological source | Homo sapiens (Human) |
Cellular location | Cytoplasm: P98170 |
Total number of polymer chains | 1 |
Total formula weight | 13175.19 |
Authors | Chessari, G.,Buck, I.M.,Day, J.E.H.,Day, P.J.,Iqbal, A.,Johnson, C.N.,Lewis, E.J.,Martins, V.,Miller, D.,Reader, M.,Rees, D.C.,Rich, S.J.,Tamanini, E.,Vitorino, M.,Ward, G.A.,Williams, P.A.,Williams, G.,Wilsher, N.E.,Woolford, A.J.-A. (deposition date: 2015-06-25, release date: 2015-08-12, Last modification date: 2024-01-10) |
Primary citation | Chessari, G.,Buck, I.M.,Day, J.E.,Day, P.J.,Iqbal, A.,Johnson, C.N.,Lewis, E.J.,Martins, V.,Miller, D.,Reader, M.,Rees, D.C.,Rich, S.J.,Tamanini, E.,Vitorino, M.,Ward, G.A.,Williams, P.A.,Williams, G.,Wilsher, N.E.,Woolford, A.J. Fragment-Based Drug Discovery Targeting Inhibitor of Apoptosis Proteins: Discovery of a Non-Alanine Lead Series with Dual Activity Against cIAP1 and XIAP. J.Med.Chem., 58:6574-6588, 2015 Cited by PubMed: 26218264DOI: 10.1021/acs.jmedchem.5b00706 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (2.33 Å) |
Structure validation
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