7XRV

Bacteroides thetaiotaomicron ferulic acid esterase - S150A (BT_4077-S150A) complex with trans-methylferulate

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, D, E... (A, B, C, D, E...)	Ferulic acid esterase	polymer	291	33323.8	10	UniProt (Q8A0E4) Pfam (PF00756)	Bacteroides thetaiotaomicron VPI-5482
2	AA, K, M, O, P... (I, A, B, C, D...)	CALCIUM ION	non-polymer		40.1	10	Chemie (CA)
3	L, N, R, T, V... (A, B, E, F, G...)	Trans-methylferulate	non-polymer		208.2	7	Chemie (SZQ)
4	BA, CA, DA, EA, FA... (A, B, C, D, E...)	water	water		18.0	462	Chemie (HOH)

Sequence modifications

A, B, C, D, E, F, G, H, I, J: 21 - 288 (UniProt: Q8A0E4)

PDB	External Database	Details
Met -2	-	initiating methionine
Gly -1	-	expression tag
Ser 0	-	expression tag
Ser 1	-	expression tag
His 2	-	expression tag
His 3	-	expression tag
His 4	-	expression tag
His 5	-	expression tag
His 6	-	expression tag
His 7	-	expression tag
Ser 8	-	expression tag
Ser 9	-	expression tag
Gly 10	-	expression tag
Leu 11	-	expression tag
Val 12	-	expression tag
Pro 13	-	expression tag
Arg 14	-	expression tag
Gly 15	-	expression tag
Ser 16	-	expression tag
His 17	-	expression tag
Met 18	-	expression tag
Leu 19	-	expression tag
Glu 20	-	expression tag
Ala 150	Ser 150	engineered mutation

Contents of the asymmetric unit

Polymers	Number of chains	10
	Total formula weight	333238.3
Non-Polymers*	Number of molecules	17
	Total formula weight	1858.3
All*	Total formula weight	335096.5

*Water molecules are not included.