3ARA

Discovery of Novel Uracil Derivatives as Potent Human dUTPase Inhibitors

Summary for 3ARA

Entry DOI	10.2210/pdb3ara/pdb
Related	1Q5H 2HQU 3EHW
Descriptor	Deoxyuridine 5'-triphosphate nucleotidohydrolase, 1-[3-({(2R)-2-[hydroxy(diphenyl)methyl]pyrrolidin-1-yl}sulfonyl)propyl]pyrimidine-2,4(1H,3H)-dione, MAGNESIUM ION, ... (4 entities in total)
Functional Keywords	hydrolase, magnesium binding, hydrolase-hydrolase inhibitor complex, hydrolase/hydrolase inhibitor
Biological source	Homo sapiens (human)
Cellular location	Isoform 2: Nucleus . Isoform 3: Mitochondrion : P33316
Total number of polymer chains	3
Total formula weight	54770.47
Authors	Chong, K.T.,Miyakoshi, H.,Miyahara, S.,Fukuoka, M. (deposition date: 2010-11-25, release date: 2010-12-08, Last modification date: 2024-03-13)
Primary citation	Miyakoshi, H.,Miyahara, S.,Yokogawa, T.,Chong, K.T.,Taguchi, J.,Endoh, K.,Yano, W.,Wakasa, T.,Ueno, H.,Takao, Y.,Nomura, M.,Shuto, S.,Nagasawa, H.,Fukuoka, M. Synthesis and discovery of N-carbonylpyrrolidine- or N-sulfonylpyrrolidine-containing uracil derivatives as potent human deoxyuridine triphosphatase inhibitors J.Med.Chem., 55:2960-2969, 2012 Cited by PubMed: 22404301 DOI: 10.1021/jm201627n PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (1.7 Å)

Structure validation