7KH8

Human LMPTP in complex with inhibitor

Summary for 7KH8

• Entry DOI: 10.2210/pdb7kh8/pdb
• Descriptor: Low molecular weight phosphotyrosine protein phosphatase, 3-[(2,6-dichlorophenyl)methyl]-8-(2-methylphenyl)-3H-purin-6-amine, NITRATE ION, ... (4 entities in total)
• Functional Keywords: protein tyrosine phosphatase, lmwptp, inhibitor, complex, hydrolase, hydrolase-hydrolase inhibitor complex, hydrolase/hydrolase inhibitor
• Biological source: Homo sapiens (Human)
• Total number of polymer chains: 2
• Total formula weight: 36609.01

Authors

Stanford, S.M.,Diaz, M.A.,Ardecky, R.J.,Zou, J.,Roosild, T.,Holmes, Z.J.,Hedrick, M.P.,Rodiles, S.,Santelli, E.,Chung, T.D.Y.,Jackson, M.R.,Bottini, N.,Pinkerton, A.B. (deposition date: 2020-10-20, release date: 2021-05-19, Last modification date: 2023-10-18)

• Primary citation: Stanford, S.M.,Diaz, M.A.,Ardecky, R.J.,Zou, J.,Roosild, T.,Holmes, Z.J.,Nguyen, T.P.,Hedrick, M.P.,Rodiles, S.,Guan, A.,Grotegut, S.,Santelli, E.,Chung, T.D.Y.,Jackson, M.R.,Bottini, N.,Pinkerton, A.B.; Discovery of Orally Bioavailable Purine-Based Inhibitors of the Low-Molecular-Weight Protein Tyrosine Phosphatase.; J.Med.Chem., 64:5645-5653, 2021; PubMed: 33914534; DOI: 10.1021/acs.jmedchem.0c02126

Experimental method

X-RAY DIFFRACTION (1.3 Å)