9VII

Crystal structure of fused glycerol dehydratase A177M 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, E, F (B, C, G, H)	Glycerol dehydrase alpha subunit,Glycerol dehydrase beta subunit	polymer	754	82562.7	4	UniProt (Q59476) UniProt (O08505)	Klebsiella pneumoniae	Glycerol dehydratase,Glycerol dehydratase medium subunit,Propanediol dehydratase,Propanediol/glycerol family dehydratase large subunit,Glycerol dehydratase medium subunit,Propanediol dehydratase,Propanediol/glycerol family dehydratase medium subunit
2	C, D, G, H (D, E, I, J)	Glycerol dehydrase gamma subunit	polymer	141	16074.3	4	UniProt (Q59475)	Klebsiella pneumoniae	Glycerol dehydratase,Glycerol dehydratase small subunit DhaB3,Glycerol dehydrogenase,Propanediol dehydratase small subunit
3	I, J, K, L (B, G, H)	COBALAMIN	non-polymer		1330.4	4	Chemie (B12)

Sequence modifications

B, C, G, H: 1 - 555 (UniProt: Q59476)

PDB	External Database	Details
Met 177	Ala 177	engineered mutation
Gln 556	-	linker
Gly 557	-	linker
Gly 558	-	linker
Ile 559	-	linker
Pro 560	-	linker
Val 561	-	linker

B, C, G, H: 562 - 754 (UniProt: O08505)
D, E, I, J: 1 - 141 (UniProt: Q59475)

PDB	External Database	Details
Cys 51	Arg 51	conflict

Contents of the asymmetric unit

Polymers	Number of chains	8
	Total formula weight	394548.0
Non-Polymers*	Number of molecules	4
	Total formula weight	5321.4
All*	Total formula weight	399869.4

*Water molecules are not included.