6PF6

Crystal structure of TS-DHFR from Cryptosporidium hominis in complex with NADPH, FdUMP and 2-(4-((2-amino-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-5-yl)methyl)benzamido)terephthalic acid

Summary for 6PF6

Entry DOI	10.2210/pdb6pf6/pdb
Descriptor	Thymidylate synthase,Thymidylate synthase, 2'-DEOXYURIDINE 5'-MONOPHOSPHATE, 2-({4-[(2-amino-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-5-yl)methyl]benzene-1-carbonyl}amino)benzene-1,4-dicarboxylic acid, ... (4 entities in total)
Functional Keywords	inhibitor, ts, transferase, transferase-transferase inhibitor complex, transferase/transferase inhibitor
Biological source	Homo sapiens (Human) More
Total number of polymer chains	4
Total formula weight	134883.81
Authors	Czyzyk, D.L.,Valhondo, M.,Jorgensen, W.L.,Anderson, K.S. (deposition date: 2019-06-21, release date: 2019-10-16, Last modification date: 2023-10-11)
Primary citation	Czyzyk, D.J.,Valhondo, M.,Deiana, L.,Tirado-Rives, J.,Jorgensen, W.L.,Anderson, K.S. Structure activity relationship towards design of cryptosporidium specific thymidylate synthase inhibitors. Eur.J.Med.Chem., 183:111673-111673, 2019 Cited by PubMed: 31536894 DOI: 10.1016/j.ejmech.2019.111673 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.502 Å)

Structure validation