6U67

Mcl-1 bound to compound 24

Summary for 6U67

• Entry DOI: 10.2210/pdb6u67/pdb
• Descriptor: Induced myeloid leukemia cell differentiation protein Mcl-1, 2-({[4-(4-tert-butylphenyl)piperazin-1-yl]sulfonyl}amino)-5-{[3-oxo-3-(phenylamino)propyl]sulfanyl}benzoic acid, BIPHENYL, ... (4 entities in total)
• Functional Keywords: anti-apoptotic, inhibitor, protein binding, apoptosis-inhibitor complex, apoptosis/inhibitor
• Biological source: Homo sapiens (Human)
• Total number of polymer chains: 2
• Total formula weight: 39565.44

Authors

Stuckey, J.A. (deposition date: 2019-08-29, release date: 2020-03-04, Last modification date: 2024-03-13)

• Primary citation: Kump, 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; PubMed: 31971799; DOI: 10.1021/acs.jmedchem.9b01442

Experimental method

X-RAY DIFFRACTION (1.84 Å)