4BUF

Crystal structure of human tankyrase 2 in complex with 2-(4- acetylphenyl)-3,4-dihydroquinazolin-4-one

Summary for 4BUF

Related4BU3 4BU5 4BU6 4BU7 4BU8 4BU9 4BUA 4BUD 4BUE 4BUI 4BUS 4BUT 4BUU 4BUV 4BUW 4BUX 4BUY
DescriptorTANKYRASE-2, 2-(4-acetylphenyl)-3,4-dihydroquinazolin-4-one, SULFATE ION, ... (6 entities in total)
Functional Keywordstransferase, protein-ligand complex, diphtheria toxin like fold, adp- ribosylation, transferase-transferase inhibitor complex
Biological sourceHOMO SAPIENS (HUMAN)
Total number of polymer chains2
Total molecular weight55827.34
Authors
Haikarainen, T.,Narwal, M.,Lehtio, L. (deposition date: 2013-06-20, release date: 2013-10-30, Last modification date: 2019-02-06)
Primary citation
Haikarainen, T.,Koivunen, J.,Narwal, M.,Venkannagari, H.,Obaji, E.,Joensuu, P.,Pihlajaniemi, T.,Lehtio, L.
Para-Substituted 2-Phenyl-3,4-Dihydroquinazolin-4-Ones as Potent and Selective Tankyrase Inhibitors.
Chemmedchem, 8:1978-, 2013
PubMed: 24130191 (PDB entries with the same primary citation)
DOI: 10.1002/CMDC.201300337
MImport into Mendeley
Experimental method
X-RAY DIFFRACTION (2.5 Å)
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Structure validation

RfreeClashscoreRamachandran outliersSidechain outliersRSRZ outliers 0.19820 1.4% 0.2%MetricValuePercentile RanksWorseBetterPercentile relative to all X-ray structuresPercentile relative to X-ray structures of similar resolution
Download full validation report