6Z9B

Human Ecto-5'-nucleotidase (CD73) in complex with AOPCP derivative A830 (compound 16 in publication) in the closed form (crystal form III)

Summary for 6Z9B

Entry DOI	10.2210/pdb6z9b/pdb
Descriptor	5'-nucleotidase, ZINC ION, CALCIUM ION, ... (5 entities in total)
Functional Keywords	zinc enzyme, nucleotide analog, inhibitor, arcus biosciences, hydrolase
Biological source	Homo sapiens (Human)
Total number of polymer chains	1
Total formula weight	59983.09
Authors	Strater, N.,Scaletti, E. (deposition date: 2020-06-03, release date: 2020-07-22, Last modification date: 2024-01-24)
Primary citation	Lawson, K.V.,Kalisiak, J.,Lindsey, E.A.,Newcomb, E.T.,Leleti, M.R.,Debien, L.,Rosen, B.R.,Miles, D.H.,Sharif, E.U.,Jeffrey, J.L.,Tan, J.B.L.,Chen, A.,Zhao, S.,Xu, G.,Fu, L.,Jin, L.,Park, T.W.,Berry, W.,Moschutz, S.,Scaletti, E.,Strater, N.,Walker, N.P.,Young, S.W.,Walters, M.J.,Schindler, U.,Powers, J.P. Discovery of AB680: A Potent and Selective Inhibitor of CD73. J.Med.Chem., 63:11448-11468, 2020 Cited by PubMed: 32614585 DOI: 10.1021/acs.jmedchem.0c00525 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.17 Å)

Structure validation