6YTR

Structure of recombinant human beta-glucocerebrosidase in complex with cyclophellitol aziridine 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 (AAA, BBB)	Lysosomal acid glucosylceramidase	polymer	497	55659.2	2	UniProt (P04062) Pfam (PF02055) Pfam (PF17189)	Homo sapiens (Human)	Lysosomal acid GCase,Acid beta-glucosidase,Alglucerase,Beta-glucocerebrosidase,Beta-GC,Cholesterol glucosyltransferase,SGTase,Cholesteryl-beta-glucosidase,D-glucosyl-N-acylsphingosine glucohydrolase,Imiglucerase
2	C (AdA)	alpha-D-mannopyranose-(1-6)-beta-D-mannopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose	branched		748.7	1	In PDB GlyTouCan (G22573RC)
3	D (BdB)	beta-D-mannopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose	branched		586.5	1	In PDB GlyTouCan (G15407YE)
4	E (BuB)	2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose	branched		424.4	1	In PDB GlyTouCan (G42666HT)
5	F, GA (AAA, BBB)	(1~{R},2~{S},3~{S},4~{S},5~{R},6~{R})-5-azanyl-6-(hydroxymethyl)cyclohexane-1,2,3,4-tetrol	non-polymer		194.2	2	Chemie (PO8)
6	G, H, HA, IA, O... (AAA, BBB)	SULFATE ION	non-polymer		96.1	7	Chemie (SO4)
7	I (AAA)	2-acetamido-2-deoxy-beta-D-glucopyranose	non-polymer		221.2	1	Chemie (NAG)
8	BA, BB, CA, CB, DA... (AAA, BBB)	1,2-ETHANEDIOL	non-polymer		62.1	42	Chemie (EDO)
9	AA, AB (AAA, BBB)	SODIUM ION	non-polymer		23.0	2	Chemie (NA)
10	HB, IB (AAA, BBB)	water	water		18.0	877	Chemie (HOH)

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	111318.4
Branched	Number of molecules	3
	Total formula weight	1759.6
Non-Polymers*	Number of molecules	54
	Total formula weight	3934.9
All*	Total formula weight	117013.0

*Water molecules are not included.