8EDE

Crystal structure of covalent inhibitor 2-chloro-N'-(N-(4-chlorophenyl)-N-methylglycyl)acetohydrazide bound to Ubiquitin C-terminal Hydrolase-L1

Summary for 8EDE

• Entry DOI: 10.2210/pdb8ede/pdb
• Descriptor: Ubiquitin carboxyl-terminal hydrolase isozyme L1, 2-[(4-chlorophenyl)-methyl-amino]-~{N}'-ethanoyl-ethanehydrazide, SULFATE ION, ... (4 entities in total)
• Functional Keywords: uchl1, deubiquitylating enzyme, inhibitor, hydrolase, hydrolase-hydrolase inhibitor complex, hydrolase/hydrolase inhibitor
• Biological source: Homo sapiens (human)
• Total number of polymer chains: 2
• Total formula weight: 50606.34

Authors

Patel, R.,Imhoff, R.,Flaherty, D.,Das, C. (deposition date: 2022-09-04, release date: 2023-09-20, Last modification date: 2024-04-10)

• Primary citation: Imhoff, R.D.,Patel, R.,Safdar, M.H.,Jones, H.B.L.,Pinto-Fernandez, A.,Vendrell, I.,Chen, H.,Muli, C.S.,Krabill, A.D.,Kessler, B.M.,Wendt, M.K.,Das, C.,Flaherty, D.P.; Covalent Fragment Screening and Optimization Identifies the Chloroacetohydrazide Scaffold as Inhibitors for Ubiquitin C-terminal Hydrolase L1.; J.Med.Chem., 67:4496-4524, 2024; PubMed: 38488146; DOI: 10.1021/acs.jmedchem.3c01661

Experimental method

X-RAY DIFFRACTION (1.799 Å)