PDBsum entry 2f70

Hydrolase

PDB id: 2f70

Contents

Protein chain

297 a.a.

Ligands

UN6

Metals

_MG

_CL ×4

Waters ×272

References listed in PDB file

Key reference

• Title: 1,2,3,4-Tetrahydroisoquinolinyl sulfamic acids as phosphatase ptp1b inhibitors.
• Authors: S.R.Klopfenstein, A.G.Evdokimov, A.O.Colson, N.T.Fairweather, J.J.Neuman, M.B.Maier, J.L.Gray, G.S.Gerwe, G.E.Stake, B.W.Howard, J.A.Farmer, M.E.Pokross, T.R.Downs, B.Kasibhatla, K.G.Peters.
• Ref.: Bioorg Med Chem Lett, 2006, 16, 1574-1578. [DOI no: 10.1016/j.bmcl.2005.12.051]
• PubMed id: 16386905

Abstract

High-throughput screening of the P&GP corporate repository against several protein tyrosine phosphatases identified the sulfamic acid moiety as potential phosphotyrosine mimetic. Incorporation of the sulfamic acid onto a 1,2,3,4-tetrahydroisoquinoline scaffold provided a promising starting point for PTP1B inhibitor design.