2VRJ

Beta-glucosidase from Thermotoga maritima in complex with N-octyl-5- deoxy-6-oxa-N-(thio)carbamoylcalystegine

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-GLUCOSIDASE A	polymer	468	53940.6	2	UniProt (Q08638) Pfam (PF00232) In PDB	THERMOTOGA MARITIMA	GENTIOBIASE, CELLOBIASE, BETA-D- GLUCOSIDE GLUCOHYDROLASE, BETA-GLUCOSIDASE
2	A, B	(1S,2R,3S,4R,5R)-2,3,4-trihydroxy-N-octyl-6-oxa-8-azabicyclo[3.2.1]octane-8-carbothioamide	non-polymer		332.5	2	Chemie (NCW)
3	A, B	CALCIUM ION	non-polymer		40.1	2	Chemie (CA)
4	A, B	ACETATE ION	non-polymer		59.0	3	Chemie (ACT)
5		water	water		18.0	669	Chemie (HOH)

Sequence modifications

A, B: -21 - 1 (PDB: 2VRJ)
A, B: 2 - 446 (UniProt: Q08638)

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	107881.3
Non-Polymers*	Number of molecules	7
	Total formula weight	922.2
All*	Total formula weight	108803.5

*Water molecules are not included.