7FQS

PanDDA analysis group deposition -- Crystal structure of PTP1B in complex with FMOOA000555a

Summary for 7FQS

Entry DOI	10.2210/pdb7fqs/pdb
Group deposition	PanDDA analysis group deposition (G_1002251)
Descriptor	Tyrosine-protein phosphatase non-receptor type 1, 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, (2R,5R,6S)-2,3,4,5,6,7-hexahydro-1H-2,6-methanoazocino[5,4-b]indol-5-ol, ... (4 entities in total)
Functional Keywords	pandda, diamond i24 fragment screening, protein tyrosine phosphatase, ptp, protein tyrosine phosphatase 1b, ptp1b, enzyme, allostery, multiconformer, hydrolase
Biological source	Homo sapiens (human)
Total number of polymer chains	1
Total formula weight	37695.99
Authors	Mehlman, T.,Biel, J.,Azeem, S.M.,Nelson, E.R.,Hossain, S.,Dunnett, L.E.,Paterson, N.G.,Douangamath, A.,Talon, R.,Axford, D.,Orins, H.,von Delft, F.,Keedy, D.A. (deposition date: 2022-10-19, release date: 2022-11-23, Last modification date: 2023-03-22)
Primary citation	Skaist Mehlman, T.,Biel, J.T.,Azeem, S.M.,Nelson, E.R.,Hossain, S.,Dunnett, L.,Paterson, N.G.,Douangamath, A.,Talon, R.,Axford, D.,Orins, H.,von Delft, F.,Keedy, D.A. Room-temperature crystallography reveals altered binding of small-molecule fragments to PTP1B. Elife, 12:-, 2023 Cited by PubMed: 36881464 DOI: 10.7554/eLife.84632 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.12 Å)

Structure validation