4R85

Crystal structure of 5-methylcytosine deaminase from Klebsiella pneumoniae liganded with 5-methylcytosine

Replaces:  4JNP

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...)	Cytosine deaminase	polymer	431	48067.5	6	UniProt (W8V4R8)	Klebsiella pneumoniae
2	AA, G, GA, L, R... (E, A, F, B, C...)	5-methylcytosine	non-polymer		125.1	6	Chemie (17E)
3	BA, H, HA, M, S... (E, A, F, B, C...)	FE (II) ION	non-polymer		55.8	6	Chemie (FE2)
4	CA, DA, EA, FA, I... (E, F, A, B, C...)	GLYCEROL	non-polymer		92.1	18	Chemie (GOL)
5	KA, LA, MA, NA, OA... (A, B, C, D, E...)	water	water		18.0	1714	Chemie (HOH)

Sequence modifications

A, B, C, D, E, F: 1 - 412 (UniProt: W8V4R8)

PDB	External Database	Details
Asn 413	-	expression tag
Ser 414	-	expression tag
Ser 415	-	expression tag
Ser 416	-	expression tag
Val 417	-	expression tag
Asp 418	-	expression tag
Lys 419	-	expression tag
Leu 420	-	expression tag
Ala 421	-	expression tag
Ala 422	-	expression tag
Ala 423	-	expression tag
Leu 424	-	expression tag
Glu 425	-	expression tag
His 426	-	expression tag
His 427	-	expression tag
His 428	-	expression tag
His 429	-	expression tag
His 430	-	expression tag
His 431	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	6
	Total formula weight	288404.7
Non-Polymers*	Number of molecules	30
	Total formula weight	2743.5
All*	Total formula weight	291148.3

*Water molecules are not included.