3NN6

Crystal structure of inhibitor-bound in active centre 6-hydroxy-L-nicotine oxidase from Arthrobacter nicotinovorans

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	X	6-hydroxy-L-nicotine oxidase	polymer	431	47214.1	1	UniProt (Q93NH4) Pfam (PF01593) In PDB	Arthrobacter nicotinovorans
2	X	5-[(2R)-1-methylpyrrolidin-2-yl]pyridin-2-ol	non-polymer		178.2	1	Chemie (HNK)
3	X	(2R,3S,4S)-5-({[(acetylcarbamoyl)amino]methyl}[(3S,4R)-6-amino-3,4-dimethylhexyl]amino)-2,3,4-trihydroxypentyl [(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl dihydrogen diphosphate (non-preferred name)	non-polymer		801.7	1	Chemie (FB0)
4	X	(1R)-2-{[(S)-(2-aminoethoxy)(hydroxy)phosphoryl]oxy}-1-[(pentadecanoyloxy)methyl]ethyl (12E)-hexadeca-9,12-dienoate	non-polymer		673.9	1	Chemie (GP7)
5		water	water		18.0	430	Chemie (HOH)

Sequence modifications

X: 1 - 425 (UniProt: Q93NH4)

PDB	External Database	Details
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	1
	Total formula weight	47214.1
Non-Polymers*	Number of molecules	3
	Total formula weight	1653.8
All*	Total formula weight	48867.9

*Water molecules are not included.