3GIY

Crystal Structures of the G81A Mutant of the Active Chimera of (S)-Mandelate Dehydrogenase and its Complex with Two of its Substrates

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A (A)	(S)-mandelate dehydrogenase, Peroxisomal (S)-2-hydroxy-acid oxidase	polymer	380	42146.3	1	UniProt (P20932) UniProt (P05414)	Pseudomonas putida	L(+)-mandelate dehydrogenase, MDH, Glycolate oxidase
2	B (A)	FLAVIN MONONUCLEOTIDE	non-polymer		456.3	1	Chemie (FMN)
3	C (A)	2-(N-MORPHOLINO)-ETHANESULFONIC ACID	non-polymer		195.2	1	Chemie (MES)
4	D (A)	water	water		18.0	284	Chemie (HOH)

Sequence modifications

A: 1 - 176 (UniProt: P20932)

PDB	External Database	Details
Ala 15	Arg 15	SEE REMARK 999
Ala 81	Gly 81	engineered mutation

A: 177 - 196 (UniProt: P05414)
A: 197 - 374 (UniProt: P20932)

PDB	External Database	Details
His 375	-	expression tag
His 376	-	expression tag
His 377	-	expression tag
His 378	-	expression tag
His 379	-	expression tag
His 380	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	1
	Total formula weight	42146.3
Non-Polymers*	Number of molecules	2
	Total formula weight	651.6
All*	Total formula weight	42797.9

*Water molecules are not included.