7QRC
X-ray structure of Trypanosoma cruzi PEX14 in complex with a PEX5-PEX14 PPI inhibitor
Summary for 7QRC
Entry DOI | 10.2210/pdb7qrc/pdb |
Descriptor | Peroxin-14, GLYCEROL, ~{N}-(5-ethyl-6-oxidanylidene-benzo[b][1,4]benzothiazepin-2-yl)-2-(4-fluorophenyl)ethanamide, ... (4 entities in total) |
Functional Keywords | structure-based drug design, inhibitor, trypanosomiasis, complex, pex5-pex14 ppi, signaling protein |
Biological source | Trypanosoma cruzi |
Total number of polymer chains | 2 |
Total formula weight | 15946.35 |
Authors | Napolitano, V.,Popowicz, G.M.,Dawidowski, M.,Dubin, G. (deposition date: 2022-01-10, release date: 2022-11-23, Last modification date: 2024-01-31) |
Primary citation | Napolitano, V.,Mroz, P.,Marciniak, M.,Kalel, V.C.,Softley, C.A.,Janna Olmos, J.D.,Tippler, B.G.,Schorpp, K.,Rioton, S.,Frohlich, T.,Plettenburg, O.,Hadian, K.,Erdmann, R.,Sattler, M.,Popowicz, G.M.,Dawidowski, M.,Dubin, G. Structure-based design, synthesis and evaluation of a novel family of PEX5-PEX14 interaction inhibitors against Trypanosoma. Eur.J.Med.Chem., 243:114778-114778, 2022 Cited by PubMed: 36194937DOI: 10.1016/j.ejmech.2022.114778 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (2.18 Å) |
Structure validation
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