7KHN

NicA2 variant N462Y/W427Y in complex with (S)-nicotine

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A (A)	Amine oxidase	polymer	490	53691.4	1	UniProt (F8G0P2) Pfam (PF01593)	Pseudomonas putida (strain S16)
2	B (A)	FLAVIN-ADENINE DINUCLEOTIDE	non-polymer		785.5	1	Chemie (FAD)
3	C, D (A)	(S)-3-(1-METHYLPYRROLIDIN-2-YL)PYRIDINE	non-polymer		162.2	2	Chemie (NCT)
4	E (A)	water	water		18.0	86	Chemie (HOH)

Sequence modifications

A: 1 - 482 (UniProt: F8G0P2)

PDB	External Database	Details
Tyr 427	Trp 427	engineered mutation
Tyr 462	Asn 462	engineered mutation
Leu 483	-	expression tag
Glu 484	-	expression tag
His 485	-	expression tag
His 486	-	expression tag
His 487	-	expression tag
His 488	-	expression tag
His 489	-	expression tag
His 490	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	1
	Total formula weight	53691.4
Non-Polymers*	Number of molecules	3
	Total formula weight	1110.0
All*	Total formula weight	54801.4

*Water molecules are not included.