1BW9

PHENYLALANINE DEHYDROGENASE STRUCTURE IN TERNARY COMPLEX WITH NAD+ AND PHENYLPYRUVATE

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A (A)	PHENYLALANINE DEHYDROGENASE	polymer	356	36559.8	1	UniProt (Q59771)	Rhodococcus sp.
2	B (B)	PHENYLALANINE DEHYDROGENASE	polymer	356	36615.9	1	UniProt (Q59771)	Rhodococcus sp.
3	C, J (A, B)	NICOTINAMIDE-ADENINE-DINUCLEOTIDE	non-polymer		663.4	2	Chemie (NAD)
4	D, K (A, B)	3-PHENYLPYRUVIC ACID	non-polymer		164.2	2	Chemie (PPY)
5	E, H (B)	POTASSIUM ION	non-polymer		39.1	2	Chemie (K)
6	F, G (B)	SODIUM ION	non-polymer		23.0	2	Chemie (NA)
7	I (B)	PHOSPHATE ION	non-polymer		95.0	1	Chemie (PO4)
8	L, M, N (B)	1,2-ETHANEDIOL	non-polymer		62.1	3	Chemie (EDO)
9	O, P, Q, R (B)	ISOPROPYL ALCOHOL	non-polymer		60.1	4	Chemie (IPA)
10	S, T (A, B)	water	water		18.0	1021	Chemie (HOH)

Sequence modifications

A: 0 - 355 (UniProt: Q59771)

PDB	External Database	Details
Ser 19	Arg 20	SEE REMARK 999
Met 20	Glu 21	SEE REMARK 999
Asn 48	Gln 49	SEE REMARK 999

B: 400 - 755 (UniProt: Q59771)

PDB	External Database	Details
Lys 419	Arg 20	SEE REMARK 999
Met 420	Glu 21	SEE REMARK 999

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	73175.8
Non-Polymers*	Number of molecules	16
	Total formula weight	2300.9
All*	Total formula weight	75476.7

*Water molecules are not included.