5IS4

Endothiapepsin in complex with chiral brominated primary amine fragment

Summary for 5IS4

• Entry DOI: 10.2210/pdb5is4/pdb
• Related: 3PMY 5DQ4
• Descriptor: Endothiapepsin, (1S)-2-amino-1-(4-bromophenyl)ethan-1-ol, TETRAETHYLENE GLYCOL, ... (7 entities in total)
• Functional Keywords: fragment screening, aspartic protease, inhibition, hydrolase
• Biological source: Cryphonectria parasitica (Chestnut blight fungus)
• Total number of polymer chains: 1
• Total formula weight: 34512.47

Authors

Radeva, N.,Heine, A.,Klebe, G. (deposition date: 2016-03-15, release date: 2017-03-29, Last modification date: 2024-01-10)

• Primary citation: Radeva, N.,Heine, A.,Klebe, G.; Crystallographic Fragment Screening of an Entire Library; to be published,

Experimental method

X-RAY DIFFRACTION (1.368 Å)