9O21

Heparanase P6 in complex with fragment J34

This is a non-PDB format compatible entry.

Summary for 9O21

• Entry DOI: 10.2210/pdb9o21/pdb
• Descriptor: Heparanase 50 kDa subunit, Heparanase 8 kDa subunit, (2S)-2-(azepan-1-yl)-1-(1H-indol-3-yl)propan-1-one, ... (8 entities in total)
• Functional Keywords: heparanase, small molecule, cancer, complex, therapeutics, hydrolase
• Biological source: Homo sapiens (human); More
• Total number of polymer chains: 2
• Total formula weight: 52022.58

Authors

Davies, L.J.,Frkic, R.L.,Jackson, C.J. (deposition date: 2025-04-03, release date: 2026-02-11)

• Primary citation: Davies, L.J.,Whitefield, C.,Kim, H.,Nitsche, C.,Jackson, C.J.,Frkic, R.L.; Fragment Screening and Structure-Guided Development of Heparanase Inhibitors Reveal Orthosteric and Allosteric Inhibition; Acs Med.Chem.Lett., 2026; DOI: 10.1021/acsmedchemlett.5c00587

Experimental method

X-RAY DIFFRACTION (1.82 Å)