5S95

PanDDA analysis group deposition -- Crystal Structure of PHIP in complex with Z198194396 synthetic derivative

Summary for 5S95

Entry DOI	10.2210/pdb5s95/pdb
Group deposition	PanDDA analysis group deposition (G_1002190)
Descriptor	PH-interacting protein, 4-(5-chlorofuran-2-carbonyl)-N-(cyclopropylmethyl)piperazine-1-carboxamide (3 entities in total)
Functional Keywords	sgc - diamond i04-1 fragment screening, pandda, xchemexplorer, robotic chemistry, crystal soaking, reaction crudes, signaling protein
Biological source	Homo sapiens (Human)
Total number of polymer chains	1
Total formula weight	17939.62
Authors	Grosjean, H.,Aimon, A.,Hassel-Hart , S.,Krojer, T.,Talon, R.,Douangamath, A.,Koekemoer, L.,Biggin, P.C.,Spencer, J.,von Delft, F. (deposition date: 2021-01-22, release date: 2021-02-17, Last modification date: 2024-03-06)
Primary citation	Grosjean, H.,Aimon, A.,Hart , S.,Krojer, T.,Talon, R.,Douangamath, A.,Koekemoer, L.,Biggin, P.C.,Spencer, J.,von Delft, F. Crystal Structures of the second bromodomain of Pleckstrin homology domain interacting protein (PHIP) in space group C2 soaked with crude reaction mixtures To Be Published,
Experimental method	X-RAY DIFFRACTION (1.21 Å)

Structure validation