4Q0D
Crystal structure of TS-DHFR from Cryptosporidium hominis in complex with NADPH, FdUMP, methotrexate and 2-amino-4-oxo-4,7-dihydro-pyrrolo[2,3-d]pyrimidine-methyl-phenyl-L-glutamic acid.
Summary for 4Q0D
Entry DOI | 10.2210/pdb4q0d/pdb |
Related | 1QZF 2OIP 3DL5 3DL6 3HJ3 4KY8 |
Descriptor | Bifunctional dihydrofolate reductase-thymidylate synthase, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, 5-FLUORO-2'-DEOXYURIDINE-5'-MONOPHOSPHATE, ... (5 entities in total) |
Functional Keywords | bifunctional enzyme, transferase, oxidoreductase, transferase-transferase inhibitor complex, transferase/transferase inhibitor |
Biological source | Cryptosporidium hominis |
Total number of polymer chains | 5 |
Total formula weight | 311009.68 |
Authors | Kumar, V.P.,Anderson, K.S. (deposition date: 2014-04-01, release date: 2014-10-15, Last modification date: 2023-09-20) |
Primary citation | Kumar, V.P.,Cisneros, J.A.,Frey, K.M.,Castellanos-Gonzalez, A.,Wang, Y.,Gangjee, A.,White, A.C.,Jorgensen, W.L.,Anderson, K.S. Structural studies provide clues for analog design of specific inhibitors of Cryptosporidium hominis thymidylate synthase-dihydrofolate reductase. Bioorg.Med.Chem.Lett., 24:4158-4161, 2014 Cited by PubMed: 25127103DOI: 10.1016/j.bmcl.2014.07.049 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (3.449 Å) |
Structure validation
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