8SNI

Hydroxynitrile Lyase from Hevea brasiliensis with Forty Mutations

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, B (A, B)	(S)-hydroxynitrile lyase	polymer	293	32793.6	2	UniProt (P52704) Pfam (PF00561)	Hevea brasiliensis (rubber tree)	(S)-acetone-cyanohydrin lyase,Oxynitrilase
2	C (A)	1,2-ETHANEDIOL	non-polymer		62.1	1	Chemie (EDO)
3	D, E (A)	SULFATE ION	non-polymer		96.1	2	Chemie (SO4)
4	F, G (A, B)	BENZOIC ACID	non-polymer		122.1	2	Chemie (BEZ)
5	H, I (A, B)	water	water		18.0	68	Chemie (HOH)

Sequence modifications

A, B: 1 - 259 (UniProt: P52704)

PDB	External Database	Details
Met -33	-	initiating methionine
Gly -32	-	expression tag
Ser -31	-	expression tag
Ser -30	-	expression tag
His -29	-	expression tag
His -28	-	expression tag
His -27	-	expression tag
His -26	-	expression tag
His -25	-	expression tag
His -24	-	expression tag
Ser -23	-	expression tag
Ser -22	-	expression tag
Gly -21	-	expression tag
Leu -20	-	expression tag
Val -19	-	expression tag
Pro -18	-	expression tag
Arg -17	-	expression tag
Gly -16	-	expression tag
Ser -15	-	expression tag
His -14	-	expression tag
Met -13	-	expression tag
Ala -12	-	expression tag
Ser -11	-	expression tag
Met -10	-	expression tag
Thr -9	-	expression tag
Gly -8	-	expression tag
Gly -7	-	expression tag
Gln -6	-	expression tag
Gln -5	-	expression tag
Met -4	-	expression tag
Gly -3	-	expression tag
Arg -2	-	expression tag
Gly -1	-	expression tag
Ser 0	-	expression tag
Val 9	Ile 9	engineered mutation
Gly 11	Thr 11	engineered mutation
Ala 12	Ile 12	engineered mutation
Ser 18	Ile 18	engineered mutation
His 79	Glu 79	engineered mutation
Leu 81	Cys 81	engineered mutation
Met 84	Leu 84	engineered mutation
Leu 103	His 103	engineered mutation
Ala 104	Asn 104	engineered mutation
Ala 105	Ser 105	engineered mutation
Phe 106	Val 106	engineered mutation
Leu 118	Val 118	engineered mutation
Tyr 121	Leu 121	engineered mutation
Asn 122	Met 122	engineered mutation
Thr 125	Phe 125	engineered mutation
Ala 127	-	insertion
Glu 128	-	insertion
Asn 129	Asp 127	engineered mutation
Leu 131	Lys 129	engineered mutation
Phe 135	Tyr 133	engineered mutation
Met 148	Leu 146	engineered mutation
Phe 149	Lys 147	engineered mutation
Phe 150	Leu 148	engineered mutation
Pro 152	Phe 150	engineered mutation
Lys 153	Thr 151	engineered mutation
Phe 154	Leu 152	engineered mutation
Ala 156	Arg 154	engineered mutation
His 157	Glu 155	engineered mutation
Lys 158	Asn 156	engineered mutation
Gln 161	Thr 159	engineered mutation
Val 175	Thr 173	engineered mutation
Ser 178	Gly 176	engineered mutation
Met 182	Gln 180	engineered mutation
Lys 210	Glu 208	engineered mutation
Gly 211	Ile 209	engineered mutation
Ile 212	Phe 210	engineered mutation
Pro 213	Leu 211	engineered mutation
Met 238	Lys 236	engineered mutation
Ala 239	Leu 237	engineered mutation
Met 240	Gln 238	engineered mutation

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	65587.2
Non-Polymers*	Number of molecules	5
	Total formula weight	498.4
All*	Total formula weight	66085.6

*Water molecules are not included.