4CRY

Direct visualisation of strain-induced protein post-translational modification

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A (A)	ASPARTATE 1-DECARBOXYLASE	polymer	41	4770.6	1	UniProt (P0A790)	ESCHERICHIA COLI K-12	ASPARTATE ALPHA-DECARBOXYLASE BETA CHAIN
2	B (B)	PANZ	polymer	137	15738.8	1	UniProt (P37613) Pfam (PF12568)	ESCHERICHIA COLI K-12
3	C (G)	ASPARTATE 1-DECARBOXYLASE	polymer	102	11041.4	1	UniProt (P0A790) Pfam (PF02261)	ESCHERICHIA COLI K-12	ASPARTATE ALPHA-DECARBOXYLASE ALPHA CHAIN
4	D (B)	ACETYL COENZYME *A	non-polymer		809.6	1	Chemie (ACO)
5	E (B)	MAGNESIUM ION	non-polymer		24.3	1	Chemie (MG)
6	F (B)	CHLORIDE ION	non-polymer		35.5	1	Chemie (CL)
7	G, H, I (A, B, G)	water	water		18.0	124	Chemie (HOH)

Sequence modifications

A: 1 - 24 (UniProt: P0A790)

PDB	External Database	Details
Met -16	-	expression tag
Arg -15	-	expression tag
Gly -14	-	expression tag
Ser -13	-	expression tag
His -12	-	expression tag
His -11	-	expression tag
His -10	-	expression tag
His -9	-	expression tag
His -8	-	expression tag
His -7	-	expression tag
Gly -6	-	expression tag
Leu -5	-	expression tag
Val -4	-	expression tag
Pro -3	-	expression tag
Arg -2	-	expression tag
Gly -1	-	expression tag
Ser 0	-	expression tag

B: 1 - 127 (UniProt: P37613)

PDB	External Database	Details
Ser 128	-	expression tag
Gly 129	-	expression tag
Leu 130	-	expression tag
Glu 131	-	expression tag
His 132	-	expression tag
His 133	-	expression tag
His 134	-	expression tag
His 135	-	expression tag
His 136	-	expression tag
His 137	-	expression tag

G: 25 - 126 (UniProt: P0A790)

PDB	External Database	Details
Val 57	Thr 57	engineered mutation

Contents of the asymmetric unit

Polymers	Number of chains	3
	Total formula weight	31550.7
Non-Polymers*	Number of molecules	3
	Total formula weight	869.3
All*	Total formula weight	32420.1

*Water molecules are not included.