8DJ3

Caspase-7 bound to novel allosteric inhibitor

Summary for 8DJ3

• Entry DOI: 10.2210/pdb8dj3/pdb
• Descriptor: Caspase-7, 2-[(2-{[(3s,5s,7s)-adamantan-1-yl]sulfamoyl}phenyl)sulfanyl]benzoic acid (3 entities in total)
• Functional Keywords: allostery, inhibitor, ternary, apoptosis-apoptosis inhibitor complex, apoptosis/apoptosis inhibitor
• Biological source: Homo sapiens (human)
• Total number of polymer chains: 2
• Total formula weight: 69575.77

Authors

Propp, J.,Kalenkiewicz, A.,Kathryn, F.H.,Spies, M.A. (deposition date: 2022-06-29, release date: 2023-07-05, Last modification date: 2023-10-25)

• Primary citation: Hobbs, K.F.,Propp, J.,Vance, N.R.,Kalenkiewicz, A.,Witkin, K.R.,Ashley Spies, M.; Allosteric Tuning of Caspase-7: Establishing the Nexus of Structure and Catalytic Power.; Chemistry, 29:e202300872-e202300872, 2023; PubMed: 37005499; DOI: 10.1002/chem.202300872

Experimental method

X-RAY DIFFRACTION (3.2 Å)