Brand  (β version)

PDB ID: 6MDB

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Ligands
Code Name Style Show Link
JE4 6-(4-amino-4-methylpiperidin-1-yl)-3-(2,3-dichlorophenyl)-5-methyl-1,5-dihydro-4h-pyrazolo[3,4-D]pyrimidin-4-one PoSSuM
PO4 Phosphate ion PoSSuM
Non-standard Residues
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Glycosylation
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Structure summary

Code : 6MDB   PDBj   RCSB PDB   PDBe
Header : HYDROLASE/HYDROLASE INHIBITOR
Title : Non-receptor Protein Tyrosine Phosphatase SHP2 in Complex with Allosteric Inhibitor Pyrazolo-pyrimidinone 5
Release Data : 2019-02-13
Compound :
mol_id molecule chains synonym
1 Tyrosine-protein phosphatase non-receptor type 11 A,B Protein-tyrosine phosphatase 1D,PTP-1D,Protein-tyrosine phosphatase 2C,PTP-2C,SH-PTP2,Shp2,SH-PTP3
ec: 3.1.3.48
Source :
mol_id organism_scientific organism_common expression_system
1 Homo sapiens  (taxid:9606) Human Escherichia coli  (taxid:562)
gene: PTPN11, PTP2C, SHPTP2
Authors : Fodor, M., Stams, T.
Keywords : SHP2, PTPN11, PROTEIN TYROSINE PHOSPHATASE, PHOSPHATASE, ALLOSTERIC INHIBITOR, HYDROLASE-HYDROLASE INHIBITOR COMPLEX, HYDROLASE
Exp. method : X-RAY DIFFRACTION ( 2.34 Å )
Citation :

6-Amino-3-methylpyrimidinones as Potent, Selective, and Orally Efficacious SHP2 Inhibitors.

Sarver, P.,Acker, M.,Bagdanoff, J.T.  et al.
(2019)  J. Med. Chem.  62 : 1793 - 1802

PubMed: 30688459
DOI: 10.1021/acs.jmedchem.8b01726

Reaction

Chain : A, B
UniProt : Q06124 (PTN11_HUMAN)
Reaction: EC: Evidence:
Physiological Direction:
H2O + O-phospho-L-tyrosyl-[protein] = L-tyrosyl-[protein] + phosphate 3.1.3.48 PROSITE- ProRule:PRU10044, PubMed:20170098, PubMed:26742426, PubMed:28074573
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