8BQB

CjCel5C endo-glucanase bound to CB396 covalent inhibitor

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, B, C	Cellulase, putative, cel5C	polymer	346	40201.9	3	UniProt (B3PF55) Pfam (PF00150) In PDB	Cellvibrio japonicus Ueda107
2	A, B, C	(1R,2S,3S,4S,5R,6R)-6-(HYDROXYMETHYL)CYCLOHEXANE-1,2,3,4,5-PENTOL	non-polymer		194.2	3	Chemie (YLL)
3	A, B, C	beta-D-glucopyranose	non-polymer		180.2	3	Chemie (BGC)
4		water	water		18.0	22	Chemie (HOH)

Sequence modifications

A, B, C: 2 - 338 (UniProt: B3PF55)

PDB	External Database	Details
Met 1	-	initiating methionine
Leu 339	-	expression tag
Glu 340	-	expression tag
His 341	-	expression tag
His 342	-	expression tag
His 343	-	expression tag
His 344	-	expression tag
His 345	-	expression tag
His 346	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	3
	Total formula weight	120605.8
Non-Polymers*	Number of molecules	6
	Total formula weight	1123.0
All*	Total formula weight	121728.8

*Water molecules are not included.