9UM4

CaPETaseM9 SEC loop of 9CL variant

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 (A, B, C, D)	Cutinase	polymer	264	28601.9	4	UniProt (A0A1M7II12) Pfam (PF12740)	Cryptosporangium aurantiacum
2	E, F, G, H (A, B, C, D)	water	water		18.0	342	Chemie (HOH)

Sequence modifications

A, B, C, D: 43 - 298 (UniProt: A0A1M7II12)

PDB	External Database	Details
Ala 41	-	expression tag
Ala 42	-	expression tag
Ala 109	Asn 109	engineered mutation
Thr 129	Val 129	engineered mutation
Arg 155	Ala 155	engineered mutation
Cys 180	Leu 180	engineered mutation
Thr 196	Gly 196	engineered mutation
Lys 198	Arg 198	engineered mutation
Cys 202	Ala 202	engineered mutation
Cys 242	Arg 242	engineered mutation
-	Pro 280	deletion
Asn 282	Ser 283	engineered mutation
His 283	Thr 284	engineered mutation
Thr 284	Gly 285	engineered mutation
Ser 285	Leu 286	engineered mutation
Asp 286	Phe 287	engineered mutation
Ser 287	Ala 288	engineered mutation
Gln 288	Pro 289	engineered mutation
Cys 290	Ser 291	engineered mutation
Leu 299	-	expression tag
Glu 300	-	expression tag
His 301	-	expression tag
His 302	-	expression tag
His 303	-	expression tag
His 304	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	4
	Total formula weight	114407.8
All*	Total formula weight	114407.8

*Water molecules are not included.