7B50

Notum complex with ARUK3003778

Summary for 7B50

Entry DOI	10.2210/pdb7b50/pdb
Descriptor	Palmitoleoyl-protein carboxylesterase NOTUM, SULFATE ION, DIMETHYL SULFOXIDE, ... (5 entities in total)
Functional Keywords	notum inhibitor, hydrolase
Biological source	Homo sapiens (Human)
Total number of polymer chains	1
Total formula weight	44595.03
Authors	Jones, E.Y.,Fish, P. (deposition date: 2020-12-03, release date: 2022-01-12, Last modification date: 2024-01-31)
Primary citation	Steadman, D.,Atkinson, B.N.,Zhao, Y.,Willis, N.J.,Frew, S.,Monaghan, A.,Patel, C.,Armstrong, E.,Costelloe, K.,Magno, L.,Bictash, M.,Jones, E.Y.,Fish, P.V.,Svensson, F. Virtual Screening Directly Identifies New Fragment-Sized Inhibitors of Carboxylesterase Notum with Nanomolar Activity. J.Med.Chem., 65:562-578, 2022 Cited by PubMed: 34939789 DOI: 10.1021/acs.jmedchem.1c01735 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (1.33 Å)

Structure validation