6QZB

Structure of Mcl-1 in complex with compound 8d

Summary for 6QZB

Entry DOI	10.2210/pdb6qzb/pdb
Related	6qxj 6qyk 6qyl 6qyn 6qyo 6qyp 6qz5 6qz6 6qz7 6qz8
Descriptor	Induced myeloid leukemia cell differentiation protein Mcl-1, (2~{R})-2-[[6-ethyl-5-(2-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]amino]-3-phenyl-propanoic acid (3 entities in total)
Functional Keywords	apoptosis-inhibitor complex, mcl1, small molecule inhibitor, apoptosis
Biological source	Homo sapiens (Human)
Total number of polymer chains	1
Total formula weight	19910.68
Authors	Dokurno, P.,Szlavik, Z.,Ondi, L.,Csekei, M.,Paczal, A.,Szabo, Z.B.,Radics, G.,Murray, J.,Davidson, J.,Chen, I.,Davis, B.,Hubbard, R.E.,Pedder, C.,Surgenor, A.E.,Smith, J.,Robertson, A.,LeToumelin-Braizat, G.,Cauquil, N.,Zarka, M.,Demarles, D.,Perron-Sierra, F.,Geneste, O.,Kotschy, A. (deposition date: 2019-03-11, release date: 2019-08-07, Last modification date: 2024-01-24)
Primary citation	Szlavik, Z.,Ondi, L.,Csekei, M.,Paczal, A.,Szabo, Z.B.,Radics, G.,Murray, J.,Davidson, J.,Chen, I.,Davis, B.,Hubbard, R.E.,Pedder, C.,Dokurno, P.,Surgenor, A.,Smith, J.,Robertson, A.,LeToumelin-Braizat, G.,Cauquil, N.,Zarka, M.,Demarles, D.,Perron-Sierra, F.,Claperon, A.,Colland, F.,Geneste, O.,Kotschy, A. Structure-Guided Discovery of a Selective Mcl-1 Inhibitor with Cellular Activity. J.Med.Chem., 62:6913-6924, 2019 Cited by PubMed: 31339316 DOI: 10.1021/acs.jmedchem.9b00134 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2 Å)

Structure validation