8QSO
Crystal structure of human Mcl-1 in complex with compound 1
Summary for 8QSO
Entry DOI | 10.2210/pdb8qso/pdb |
Descriptor | Maltose/maltodextrin-binding periplasmic protein,Induced myeloid leukemia cell differentiation protein Mcl-1, alpha-D-glucopyranose-(1-4)-alpha-D-glucopyranose, (13S,16R,19S)-16-benzyl-43-ethoxy-N-methyl-7,11,14,17-tetraoxo-13-phenyl-5-oxa-2,8,12,15,18-pentaaza-1(1,4),4(1,2)-dibenzena-9(1,4)-cyclohexanacycloicosaphane-19-carboxamide, ... (4 entities in total) |
Functional Keywords | mcl-1, inhibitor, transferase |
Biological source | Homo sapiens (human) More |
Total number of polymer chains | 1 |
Total formula weight | 58456.14 |
Authors | Hekking, K.F.W.,Gremmen, S.,Maroto, S.,Keefe, A.D.,Zhang, Y. (deposition date: 2023-10-10, release date: 2024-02-14, Last modification date: 2024-03-06) |
Primary citation | Hekking, K.F.W.,Maroto, S.,van Kekem, K.,Haasjes, F.S.,Slootweg, J.C.,Oude Alink, P.G.B.,Dirks, R.,Sardana, M.,Bolster, M.G.,Kuijpers, B.,Smith, D.,Doodeman, R.,Scheepstra, M.,Zech, B.,Mulvihill, M.,Renzetti, L.M.,Babiss, L.,Centrella, P.A.,Clark, M.A.,Cuozzo, J.W.,Guie, M.A.,Sigel, E.,Habeshian, S.,Hupp, C.D.,Liu, J.,Thomson, H.A.,Zhang, Y.,Keefe, A.D.,Muller, G.,Gremmen, S. Development of Potent Mcl-1 Inhibitors: Structural Investigations on Macrocycles Originating from a DNA-Encoded Chemical Library Screen. J.Med.Chem., 67:3039-3065, 2024 Cited by PubMed: 38306405DOI: 10.1021/acs.jmedchem.3c02206 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (2.106 Å) |
Structure validation
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