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Yorodumi- PDB-4q0e: Crystal structure of TS-DHFR from Cryptosporidium hominis in comp... -
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-Basic information
Entry | Database: PDB / ID: 4q0e | ||||||
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Title | Crystal structure of TS-DHFR from Cryptosporidium hominis in complex with NADPH, FdUMP and 2-amino-4-oxo-4,7-dihydro-pyrrolo[2,3-d]pyrimidine-methyl-phenyl-L-glutamic acid. | ||||||
Components | Bifunctional dihydrofolate reductase-thymidylate synthase | ||||||
Keywords | transferase/transferase inhibitor / bifunctional enzyme / transferase / oxidoreductase / transferase-transferase inhibitor complex | ||||||
Function / homology | Function and homology information Thymidylate Synthase; Chain A / Thymidylate synthase/dCMP hydroxymethylase domain / Dihydrofolate Reductase, subunit A / Dihydrofolate Reductase, subunit A / 2-Layer Sandwich / 3-Layer(aba) Sandwich / Alpha Beta Similarity search - Domain/homology | ||||||
Biological species | Cryptosporidium hominis (eukaryote) | ||||||
Method | X-RAY DIFFRACTION / SYNCHROTRON / MOLECULAR REPLACEMENT / Resolution: 2.78 Å | ||||||
Authors | Kumar, V.P. / Anderson, K.S. | ||||||
Citation | Journal: Bioorg.Med.Chem.Lett. / Year: 2014 Title: Structural studies provide clues for analog design of specific inhibitors of Cryptosporidium hominis thymidylate synthase-dihydrofolate reductase. Authors: 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. | ||||||
History |
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-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Downloads & links
-Download
PDBx/mmCIF format | 4q0e.cif.gz | 521 KB | Display | PDBx/mmCIF format |
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PDB format | pdb4q0e.ent.gz | 431.6 KB | Display | PDB format |
PDBx/mmJSON format | 4q0e.json.gz | Tree view | PDBx/mmJSON format | |
Others | Other downloads |
-Validation report
Arichive directory | https://data.pdbj.org/pub/pdb/validation_reports/q0/4q0e ftp://data.pdbj.org/pub/pdb/validation_reports/q0/4q0e | HTTPS FTP |
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-Related structure data
Related structure data | 4q0dC 4ky8S S: Starting model for refinement C: citing same article (ref.) |
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Similar structure data |
-Links
-Assembly
Deposited unit |
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Unit cell |
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Noncrystallographic symmetry (NCS) | NCS domain:
NCS domain segments: Ens-ID: 1
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