3WWP

S-selective hydroxynitrile lyase from Baliospermum montanum (apo2)

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, G, L, M...)	(S)-hydroxynitrile lyase	polymer	288	32515.6	6	UniProt (D1MX73) Pfam (PF00561)	Baliospermum montanum
2	AA, G, HA, P, QA... (G, A, L, B, M...)	CITRIC ACID	non-polymer		192.1	6	Chemie (CIT)
3	BA, CA, H, I, IA... (G, A, L, B, M...)	1,2-ETHANEDIOL	non-polymer		62.1	19	Chemie (EDO)
4	AB, BB, DA, EA, FA... (R, G, A, L, B)	SULFATE ION	non-polymer		96.1	18	Chemie (SO4)
5	CB, GA, O, PA, UA... (R, G, A, L, M...)	CHLORIDE ION	non-polymer		35.5	6	Chemie (CL)
6	DB, EB, FB, GB, HB... (A, B, G, L, M...)	water	water		18.0	1849	Chemie (HOH)

Sequence modifications

A, B, G, L, M, R: 1 - 263 (UniProt: D1MX73)

PDB	External Database	Details
Met -24	-	expression tag
Asn -23	-	expression tag
His -22	-	expression tag
Lys -21	-	expression tag
Val -20	-	expression tag
His -19	-	expression tag
His -18	-	expression tag
His -17	-	expression tag
His -16	-	expression tag
His -15	-	expression tag
His -14	-	expression tag
Ile -13	-	expression tag
Glu -12	-	expression tag
Gly -11	-	expression tag
Arg -10	-	expression tag
His -9	-	expression tag
Met -8	-	expression tag
Glu -7	-	expression tag
Leu -6	-	expression tag
Gly -5	-	expression tag
Thr -4	-	expression tag
Leu -3	-	expression tag
Glu -2	-	expression tag
Gly -1	-	expression tag
Phe 0	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	6
	Total formula weight	195093.7
Non-Polymers*	Number of molecules	49
	Total formula weight	4273.9
All*	Total formula weight	199367.6

*Water molecules are not included.