6DTE

GlcNAc-inspired cyclophellitol bound to NagZ

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, B	Beta-hexosaminidase	polymer	350	38116.8	2	UniProt (A0A125HFC0) Pfam (PF00933) In PDB	Burkholderia cenocepacia	Beta-N-acetylhexosaminidase,N-acetyl-beta-glucosaminidase
2	A, B	2,2,2-trifluoro-N-[(1R,2R,3R,4R,5R,6R)-2,3,5,6-tetrahydroxy-4-(hydroxymethyl)cyclohexyl]acetamide	non-polymer		289.2	2	Chemie (H9J)
3		water	water		18.0	843	Chemie (HOH)

Sequence modifications

A, B: 1 - 342 (UniProt: A0A125HFC0)

PDB	External Database	Details
Met -7	-	initiating methionine
Ala -6	-	expression tag
His -5	-	expression tag
His -4	-	expression tag
His -3	-	expression tag
His -2	-	expression tag
His -1	-	expression tag
His 0	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	76233.5
Non-Polymers*	Number of molecules	2
	Total formula weight	578.4
All*	Total formula weight	76811.9

*Water molecules are not included.