7PR9

Crystal structure of Burkholderia pseudomallei heparanase in complex with covalent inhibitor VL166

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, B (A, B)	Glyco_hydro_44 domain-containing protein	polymer	438	44638.6	2	UniProt (Q63T97)	Burkholderia pseudomallei (strain K96243)
2	C, D (C, D)	2-acetamido-2-deoxy-alpha-D-glucopyranose-(1-4)-(2R,3S,5R,6R)-2,3,4,5,6-pentakis(oxidanyl)cyclohexane-1-carboxylic acid	branched		411.4	2	In PDB
3	E, F, G, H, I... (A, B)	1,2-ETHANEDIOL	non-polymer		62.1	6	Chemie (EDO)
4	K, L (A, B)	water	water		18.0	992	Chemie (HOH)

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	89277.2
Branched	Number of molecules	2
	Total formula weight	822.7
Non-Polymers*	Number of molecules	6
	Total formula weight	372.4
All*	Total formula weight	90472.3

*Water molecules are not included.