4F3X

Crystal structure of putative aldehyde dehydrogenase from Sinorhizobium meliloti 1021 complexed with NAD

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)	Putative aldehyde dehydrogenase	polymer	498	54532.4	4	UniProt (Q92ND9) Pfam (PF00171)	Sinorhizobium meliloti
2	E, H, J, L (A, B, C, D)	NICOTINAMIDE-ADENINE-DINUCLEOTIDE	non-polymer		663.4	4	Chemie (NAD)
3	F, G, I, K, M (A, B, C, D)	GLYCEROL	non-polymer		92.1	5	Chemie (GOL)
4	N, O, P, Q (A, B, C, D)	water	water		18.0	642	Chemie (HOH)

Sequence modifications

A, B, C, D: 1 - 475 (UniProt: Q92ND9)

PDB	External Database	Details
Mse -22	-	expression tag
His -21	-	expression tag
His -20	-	expression tag
His -19	-	expression tag
His -18	-	expression tag
His -17	-	expression tag
His -16	-	expression tag
Ser -15	-	expression tag
Ser -14	-	expression tag
Gly -13	-	expression tag
Val -12	-	expression tag
Asp -11	-	expression tag
Leu -10	-	expression tag
Gly -9	-	expression tag
Thr -8	-	expression tag
Glu -7	-	expression tag
Asn -6	-	expression tag
Leu -5	-	expression tag
Tyr -4	-	expression tag
Phe -3	-	expression tag
Gln -2	-	expression tag
Ser -1	-	expression tag
Mse 0	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	4
	Total formula weight	218129.6
Non-Polymers*	Number of molecules	9
	Total formula weight	3114.2
All*	Total formula weight	221243.7

*Water molecules are not included.