6QXJ

Structure of MBP-Mcl-1 in complex with compound 6a

Summary for 6QXJ

Entry DOI	10.2210/pdb6qxj/pdb
Related PRD ID	PRD_900001
Descriptor	Maltose-binding periplasmic protein,Induced myeloid leukemia cell differentiation protein Mcl-1, alpha-D-glucopyranose-(1-4)-alpha-D-glucopyranose, (2~{R})-2-[[6-ethyl-5-(1~{H}-indol-5-yl)thieno[2,3-d]pyrimidin-4-yl]amino]propanoic acid, ... (5 entities in total)
Functional Keywords	apoptosis-inhibitor complex, mcl1, small molecule inhibitor, mbp, apoptosis
Biological source	Escherichia coli O157:H7 More
Total number of polymer chains	1
Total formula weight	57957.59
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: 2019-03-07, 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 (1.7 Å)

Structure validation