5VKC
Crystal structure of MCL-1 in complex with a BIM competitive inhibitor
Summary for 5VKC
Entry DOI | 10.2210/pdb5vkc/pdb |
Descriptor | Induced myeloid leukemia cell differentiation protein Mcl-1, 7-(3-{[4-(4-acetylpiperazin-1-yl)phenoxy]methyl}-1,5-dimethyl-1H-pyrazol-4-yl)-3-{3-[(naphthalen-1-yl)oxy]propyl}-1-[(pyridin-3-yl)methyl]-1H-indole-2-carboxylic acid, ZINC ION, ... (4 entities in total) |
Functional Keywords | mcl-1, signaling protein-inhibitor complex, signaling protein/inhibitor |
Biological source | Homo sapiens (Human) |
Cellular location | Membrane ; Single-pass membrane protein : Q07820 |
Total number of polymer chains | 2 |
Total formula weight | 37944.66 |
Authors | Judge, R.A.,Souers, A.J. (deposition date: 2017-04-21, release date: 2017-05-03, Last modification date: 2024-03-13) |
Primary citation | Bruncko, M.,Wang, L.,Sheppard, G.S.,Phillips, D.C.,Tahir, S.K.,Xue, J.,Erickson, S.,Fidanze, S.,Fry, E.,Hasvold, L.,Jenkins, G.J.,Jin, S.,Judge, R.A.,Kovar, P.J.,Madar, D.,Nimmer, P.,Park, C.,Petros, A.M.,Rosenberg, S.H.,Smith, M.L.,Song, X.,Sun, C.,Tao, Z.F.,Wang, X.,Xiao, Y.,Zhang, H.,Tse, C.,Leverson, J.D.,Elmore, S.W.,Souers, A.J. Structure-guided design of a series of MCL-1 inhibitors with high affinity and selectivity. J. Med. Chem., 58:2180-2194, 2015 Cited by PubMed: 25679114DOI: 10.1021/jm501258m PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (2.31 Å) |
Structure validation
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