5MB5

Cocktail experiment C: fragments 103 and 171 in complex with Endothiapepsin

Summary for 5MB5

• Entry DOI: 10.2210/pdb5mb5/pdb
• Related: 3T7P
• Descriptor: Endothiapepsin, DIMETHYL SULFOXIDE, GLYCEROL, ... (6 entities in total)
• Functional Keywords: fragment screening, hydrolase, inhibition
• Biological source: Cryphonectria parasitica (Chestnut blight fungus)
• Total number of polymer chains: 1
• Total formula weight: 34407.61

Authors

Radeva, N.,Heine, A.,Klebe, G. (deposition date: 2016-11-07, release date: 2018-01-17, Last modification date: 2024-01-17)

• Primary citation: Radeva, N.,Heine, A.,Klebe, G.; Comparison of cocktails versus single soaking experiments; To Be Published,

Experimental method

X-RAY DIFFRACTION (0.98 Å)