6UVG
Crystal structure of BCL-XL bound to compound 13: (R)-2-(3-([1,1'-Biphenyl]-4-carbonyl)-3-(4-methylbenzyl)ureido)-3-(((3R,5R,7R)-adamantan-1-ylmethyl)sulfonyl)propanoic acid
Summary for 6UVG
Entry DOI | 10.2210/pdb6uvg/pdb |
Descriptor | Bcl-2-like protein 1, (R)-2-(3-([1,1'-Biphenyl]-4-carbonyl)-3-(4-methylbenzyl)ureido)-3-(((3R,5R,7R)-adamantan-1-ylmethyl)sulfonyl)propanoic acid, SULFATE ION, ... (5 entities in total) |
Functional Keywords | apoptosis, bcl-2 family, bcl-xl, inhibitor, apoptosis-inhibitor complex, apoptosis/inhibitor |
Biological source | Homo sapiens (Human) More |
Total number of polymer chains | 12 |
Total formula weight | 223639.69 |
Authors | Roy, M.J.,Lessene, G.,Czabotar, P.E. (deposition date: 2019-11-02, release date: 2021-05-05, Last modification date: 2023-10-11) |
Primary citation | Roy, M.J.,Vom, A.,Okamoto, T.,Smith, B.J.,Birkinshaw, R.W.,Yang, H.,Abdo, H.,White, C.A.,Segal, D.,Huang, D.C.S.,Baell, J.B.,Colman, P.M.,Czabotar, P.E.,Lessene, G. Structure-Guided Development of Potent Benzoylurea Inhibitors of BCL-X L and BCL-2. J.Med.Chem., 64:5447-5469, 2021 Cited by PubMed: 33904752DOI: 10.1021/acs.jmedchem.0c01771 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (2.1 Å) |
Structure validation
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