4XIR

Discovery of novel oxazepine and diazepine carboxamides as two new classes of heat shock protein 90 inhibitors

Summary for 4XIR

• Entry DOI: 10.2210/pdb4xir/pdb
• Related: 4XIP 4XIQ 4XIT
• Descriptor: Heat shock protein HSP 90-alpha, (6S)-2-chloro-8,11,11-trimethyl-9-oxo-6-propyl-6,7,9,10,11,12-hexahydroindolo[2,1-d][1,5]benzoxazepine-3-carboxamide, GLYCEROL, ... (4 entities in total)
• Functional Keywords: chaperone-chaperone inhibitor complex, chaperone/chaperone inhibitor
• Biological source: Homo sapiens (Human)
• Cellular location: Cytoplasm: P07900
• Total number of polymer chains: 1
• Total formula weight: 26690.42

Authors

Neubert, T.,Zuccola, H.J. (deposition date: 2015-01-07, release date: 2015-03-04, Last modification date: 2024-02-28)

• Primary citation: Neubert, T.,Numa, M.,Ernst, J.,Clemens, J.,Krenitsky, P.,Liu, M.,Fleck, B.,Woody, L.,Zuccola, H.,Stamos, D.; Discovery of novel oxazepine and diazepine carboxamides as two new classes of heat shock protein 90 inhibitors.; Bioorg.Med.Chem.Lett., 25:1338-1342, 2015; PubMed: 25677667; DOI: 10.1016/j.bmcl.2015.01.023

Experimental method

X-RAY DIFFRACTION (1.7 Å)