7K9W
Cryptococcus neoformans Hsp90 nucleotide binding domain in complex with BUCMD00461
Summary for 7K9W
Entry DOI | 10.2210/pdb7k9w/pdb |
Related | 7K9R 7K9S 7K9U 7K9V |
Descriptor | Hsp90-like protein, (1,3-dihydro-2H-isoindol-2-yl)(2,4-dihydroxy-6-{[3-(3-methoxyphenyl)-1-methyl-1H-pyrazol-5-yl]amino}phenyl)methanone, BENZAMIDINE, ... (5 entities in total) |
Functional Keywords | cryptococcus, hsp90, atp-binding, inhibitor, chaperone |
Biological source | Cryptococcus neoformans |
Total number of polymer chains | 2 |
Total formula weight | 50135.96 |
Authors | Kuntz, D.A.,Prive, G.G. (deposition date: 2020-09-29, release date: 2021-01-27, Last modification date: 2023-10-18) |
Primary citation | Marcyk, P.T.,LeBlanc, E.V.,Kuntz, D.A.,Xue, A.,Ortiz, F.,Trilles, R.,Bengtson, S.,Kenney, T.M.G.,Huang, D.S.,Robbins, N.,Williams, N.S.,Krysan, D.J.,Prive, G.G.,Whitesell, L.,Cowen, L.E.,Brown, L.E. Fungal-Selective Resorcylate Aminopyrazole Hsp90 Inhibitors: Optimization of Whole-Cell Anticryptococcal Activity and Insights into the Structural Origins of Cryptococcal Selectivity. J.Med.Chem., 64:1139-1169, 2021 Cited by PubMed: 33444025DOI: 10.1021/acs.jmedchem.0c01777 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (2.13 Å) |
Structure validation
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