6HML

POLYADPRIBOSYL GLYCOSIDASE IN COMPLEX WITH PDD00017299

Summary for 6HML

Entry DOI	10.2210/pdb6hml/pdb
Descriptor	Poly(ADP-ribose) glycohydrolase, 1-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-6-[[(1-methylcyclopropyl)amino]-bis(oxidanyl)-$l^{4}-sulfanyl]-3-[(1-methylpyrazol-4-yl)methyl]quinazoline-2,4-dione, DIMETHYL SULFOXIDE, ... (6 entities in total)
Functional Keywords	hydrolase
Biological source	Homo sapiens (Human)
Total number of polymer chains	1
Total formula weight	62315.93
Authors	Tucker, J.A.,Barkauskaite, E. (deposition date: 2018-09-12, release date: 2018-11-14, Last modification date: 2024-01-24)
Primary citation	Waszkowycz, B.,Smith, K.M.,McGonagle, A.E.,Jordan, A.M.,Acton, B.,Fairweather, E.E.,Griffiths, L.A.,Hamilton, N.M.,Hamilton, N.S.,Hitchin, J.R.,Hutton, C.P.,James, D.I.,Jones, C.D.,Jones, S.,Mould, D.P.,Small, H.F.,Stowell, A.I.J.,Tucker, J.A.,Waddell, I.D.,Ogilvie, D.J. Cell-Active Small Molecule Inhibitors of the DNA-Damage Repair Enzyme Poly(ADP-ribose) Glycohydrolase (PARG): Discovery and Optimization of Orally Bioavailable Quinazolinedione Sulfonamides. J.Med.Chem., 61:10767-10792, 2018 Cited by PubMed: 30403352 DOI: 10.1021/acs.jmedchem.8b01407 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.25 Å)

Structure validation