5QIE

PanDDA analysis group deposition of models with modelled events (e.g. bound ligands) -- Crystal Structure of HAO1 in complex with Z2856434894

Summary for 5QIE

Group depositionPanDDA analysis group deposition of models with modelled events (e.g. bound ligands) (G_1002048)
DescriptorHydroxyacid oxidase 1, FLAVIN MONONUCLEOTIDE, ~{N},~{N}-dimethyl-4-[(propan-2-ylamino)methyl]aniline, ... (4 entities in total)
Functional Keywordspandda, sgc - diamond i04-1 fragment screening, hao1, xchemexplorer, oxidoreductase
Biological sourceHomo sapiens (Human)
Total number of polymer chains1
Total molecular weight41469.64
Authors
Primary citation
MacKinnon, S.,Bezerra, G.A.,Krojer, T.,Bradley, A.R.,Talon, R.,Brandao-Neto, J.,Douangamath, A.,von Delft, F.,Arrowsmith, C.H.,Edwards, A.,Bountra, C.,Oppermann, U.,Brennan, P.E.,Yue, W.W.
PanDDA analysis group deposition of models with modelled events (e.g. bound ligands)
To Be Published,
Experimental method
X-RAY DIFFRACTION (1.34 Å)
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Structure validation

RfreeClashscoreRamachandran outliersSidechain outliersRSRZ outliers0.200000.7%4.2%MetricValuePercentile RanksWorseBetterPercentile relative to all X-ray structuresPercentile relative to X-ray structures of similar resolution
Download full validation report