9ELB

Structure of glucocerebrosidase in complex with a covalent inhibitor

This is a non-PDB format compatible entry.

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)	Glucosylceramidase	polymer	497	55640.2	2	UniProt (B2R6A7)	Homo sapiens (human)	Glucocerebrosidase
2	C, D (E, F)	2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose	branched		424.4	2	In PDB GlyTouCan (G42666HT)
3	E, Y (A, B)	(1S,2R,3R,4S,5S)-5-(octylamino)cyclohexane-1,2,3,4-tetrol	non-polymer		275.4	2	Chemie (A1BLU)
4	AA, F, Z (B, A)	2-acetamido-2-deoxy-beta-D-glucopyranose	non-polymer		221.2	3	Chemie (NAG) PubChem (24139)
5	BA, CA, DA, EA, FA... (B, A)	SULFATE ION	non-polymer		96.1	10	Chemie (SO4)
6	GA, HA, IA, JA, KA... (B, A)	1,2-ETHANEDIOL	non-polymer		62.1	24	Chemie (EDO)
7	RA, SA (A, B)	water	water		18.0	396	Chemie (HOH)

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	111280.3
Branched	Number of molecules	2
	Total formula weight	848.8
Non-Polymers*	Number of molecules	39
	Total formula weight	3664.7
All*	Total formula weight	115793.8

*Water molecules are not included.