8ETO
Co-crystal structure of Chaetomium glucosidase with compound 25
This is a non-PDB format compatible entry.
Summary for 8ETO
Entry DOI | 10.2210/pdb8eto/pdb |
Descriptor | Chaetomium alpha glucosidase, (1S,2S,3R,4S,5S)-1-(hydroxymethyl)-5-{[(5Z)-6-{[2-nitro-4-(2H-1,2,3-triazol-2-yl)phenyl]amino}hex-5-en-1-yl]amino}cyclohexane-1,2,3,4-tetrol, GLYCEROL, ... (7 entities in total) |
Functional Keywords | alpha glucosidase i, hydrolase, inhibitor complex, hydrolase-inhibitor complex, hydrolase/inhibitor |
Biological source | Thermochaetoides thermophila |
Total number of polymer chains | 2 |
Total formula weight | 190157.69 |
Authors | Karade, S.S.,Mariuzza, R.A. (deposition date: 2022-10-17, release date: 2023-02-22, Last modification date: 2024-10-16) |
Primary citation | Karade, S.S.,Franco, E.J.,Rojas, A.C.,Hanrahan, K.C.,Kolesnikov, A.,Yu, W.,MacKerell Jr., A.D.,Hill, D.C.,Weber, D.J.,Brown, A.N.,Treston, A.M.,Mariuzza, R.A. Structure-Based Design of Potent Iminosugar Inhibitors of Endoplasmic Reticulum alpha-Glucosidase I with Anti-SARS-CoV-2 Activity. J.Med.Chem., 66:2744-2760, 2023 Cited by PubMed: 36762932DOI: 10.1021/acs.jmedchem.2c01750 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (2.3 Å) |
Structure validation
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