7BWP

Crystal complex of endo-deglycosylated PcHNL5 with (R)-mandelonitrile

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A	PREDICTED: (R)-mandelonitrile lyase	polymer	542	59186.6	1	UniProt (A0A5E4GBK6) Pfam (PF00732) Pfam (PF05199) UniProt (by SIFTS) (O24243) In PDB	Prunus dulcis (Almond)
2	A	(2R)-hydroxy(phenyl)ethanenitrile	non-polymer		133.1	1	Chemie (MXN)
3	A	2-acetamido-2-deoxy-beta-D-glucopyranose	non-polymer		221.2	6	Chemie (NAG)
4	A	FLAVIN-ADENINE DINUCLEOTIDE	non-polymer		785.5	1	Chemie (FAD)
5	A	PHOSPHATE ION	non-polymer		95.0	1	Chemie (PO4)
6	A	DI(HYDROXYETHYL)ETHER	non-polymer		106.1	1	Chemie (PEG)
7		water	water		18.0	448	Chemie (HOH)

Sequence modifications

A: 1 - 532 (UniProt: A0A5E4GBK6)

PDB	External Database	Details
Glu -9	-	expression tag
Ala -8	-	expression tag
Glu -7	-	expression tag
Ala -6	-	expression tag
His -5	-	expression tag
His -4	-	expression tag
His -3	-	expression tag
His -2	-	expression tag
His -1	-	expression tag
His 0	-	expression tag
Met 532	Gln 559	conflict

Contents of the asymmetric unit

Polymers	Number of chains	1
	Total formula weight	59186.6
Non-Polymers*	Number of molecules	10
	Total formula weight	2447.0
All*	Total formula weight	61633.6

*Water molecules are not included.