7NA1

HDM2 in complex with compound 2

Summary for 7NA1

• Entry DOI: 10.2210/pdb7na1/pdb
• Descriptor: E3 ubiquitin-protein ligase Mdm2, 8-(1-benzothiophen-5-yl)-7-[(4-chlorophenyl)methyl]-6-{[(1R)-1-cyclopropylethyl]amino}-7H-purine-2-carboxylic acid, SULFATE ION, ... (6 entities in total)
• Functional Keywords: p53, drug design, protein-protein interactions, transferase
• Biological source: Homo sapiens (Human)
• Total number of polymer chains: 2
• Total formula weight: 26440.93

Authors

Scapin, G. (deposition date: 2021-06-19, release date: 2021-11-10, Last modification date: 2021-11-24)

• Primary citation: Reutershan, M.H.,Machacek, M.R.,Altman, M.D.,Bogen, S.,Cai, M.,Cammarano, C.,Chen, D.,Christopher, M.,Cryan, J.,Daublain, P.,Fradera, X.,Geda, P.,Goldenblatt, P.,Hill, A.D.,Kemper, R.A.,Kutilek, V.,Li, C.,Martinez, M.,McCoy, M.,Nair, L.,Pan, W.,Thompson, C.F.,Scapin, G.,Shizuka, M.,Spatz, M.L.,Steinhuebel, D.,Sun, B.,Voss, M.E.,Wang, X.,Yang, L.,Yeh, T.C.,Dussault, I.,Marshall, C.G.,Trotter, B.W.; Discovery of MK-4688 : an Efficient Inhibitor of the HDM2-p53 Protein-Protein Interaction.; J.Med.Chem., 64:16213-16241, 2021; PubMed: 34714078; DOI: 10.1021/acs.jmedchem.1c01524

Experimental method

X-RAY DIFFRACTION (2.3 Å)