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6U6F

The crystal structure of anti-apoptotic Mcl-1 protein in complex with 2, 5-substituted benzoic acid inhibitor 21

Summary for 6U6F
Entry DOI10.2210/pdb6u6f/pdb
Related6U63 6U64 6U65 6U67
DescriptorInduced myeloid leukemia cell differentiation protein Mcl-1, 2-[({4-[(4-tert-butylphenyl)methyl]piperazin-1-yl}sulfonyl)amino]-5-[(2-phenylethyl)sulfanyl]benzoic acid (3 entities in total)
Functional Keywordsapoptosis, mcl1, bfl1/a1, protein-protein interaction, bh3 mimetics, cancer, apoptosis-inhibitor complex, apoptosis/inhibitor
Biological sourceHomo sapiens (Human)
Total number of polymer chains3
Total formula weight55785.74
Authors
Yang, Y.,Stuckey, J.A.,Nikolovska-Coleska, Z. (deposition date: 2019-08-29, release date: 2020-03-04, Last modification date: 2023-10-11)
Primary citationKump, K.J.,Miao, L.,Mady, A.S.A.,Ansari, N.H.,Shrestha, U.K.,Yang, Y.,Pal, M.,Liao, C.,Perdih, A.,Abulwerdi, F.A.,Chinnaswamy, K.,Meagher, J.L.,Carlson, J.M.,Khanna, M.,Stuckey, J.A.,Nikolovska-Coleska, Z.
Discovery and Characterization of 2,5-Substituted Benzoic Acid Dual Inhibitors of the Anti-apoptotic Mcl-1 and Bfl-1 Proteins.
J.Med.Chem., 63:2489-2510, 2020
Cited by
PubMed: 31971799
DOI: 10.1021/acs.jmedchem.9b01442
PDB entries with the same primary citation
Experimental method
X-RAY DIFFRACTION (2.9 Å)
Structure validation

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