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5QGD

PanDDA analysis group deposition -- Crystal structure of PTP1B in complex with compound_FMOOA000611a

Summary for 5QGD
Entry DOI10.2210/pdb5qgd/pdb
Group depositionPanDDA analysis group deposition of models with modelled events (e.g. bound ligands) (G_1002043)
DescriptorTyrosine-protein phosphatase non-receptor type 1, (1R,3R,4S)-3-(methoxymethyl)-2-(methylsulfonyl)-2-azabicyclo[2.2.2]octan-4-ol, 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, ... (4 entities in total)
Functional Keywordspandda, sgc - diamond i04-1 fragment screening, protein tyrosine phosphatase, ptp, protein tyrosine phosphatase 1b, ptp1b, enzyme, allostery, multiconformer, hydrolase
Biological sourceHomo sapiens (Human)
Total number of polymer chains1
Total formula weight37717.03
Authors
Keedy, D.A.,Hill, Z.B.,Biel, J.T.,Kang, E.,Rettenmaier, T.J.,Brandao-Neto, J.,von Delft, F.,Wells, J.A.,Fraser, J.S. (deposition date: 2018-08-30, release date: 2018-10-10, Last modification date: 2024-03-06)
Primary citationKeedy, D.A.,Hill, Z.B.,Biel, J.T.,Kang, E.,Rettenmaier, T.J.,Brandao-Neto, J.,Pearce, N.M.,von Delft, F.,Wells, J.A.,Fraser, J.S.
An expanded allosteric network in PTP1B by multitemperature crystallography, fragment screening, and covalent tethering.
Elife, 7:-, 2018
Cited by
PubMed: 29877794
DOI: 10.7554/eLife.36307
PDB entries with the same primary citation
Experimental method
X-RAY DIFFRACTION (1.661 Å)
Structure validation

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