4E12

Substrate-directed dual catalysis of dicarbonyl compounds by diketoreductase

Functional Information from GO Data

Chain	GOid	namespace	contents
A	0000166	molecular_function	nucleotide binding
A	0003857	molecular_function	(3S)-3-hydroxyacyl-CoA dehydrogenase (NAD+) activity
A	0006629	biological_process	lipid metabolic process
A	0006631	biological_process	fatty acid metabolic process
A	0006635	biological_process	fatty acid beta-oxidation
A	0016491	molecular_function	oxidoreductase activity
A	0016616	molecular_function	oxidoreductase activity, acting on the CH-OH group of donors, NAD or NADP as acceptor
A	0070403	molecular_function	NAD+ binding

Functional Information from PDB Data

site_id	AC1
Number of Residues	6
Details	BINDING SITE FOR RESIDUE GOL A 401

Chain	Residue
A	TYR75
A	SER76
A	ASP77
A	ASP78
A	GLN81
A	GLN81

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site_id	AC2
Number of Residues	3
Details	BINDING SITE FOR RESIDUE GOL A 402

Chain	Residue
A	GLU234
A	TYR281
A	ARG282

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site_id	AC3
Number of Residues	3
Details	BINDING SITE FOR RESIDUE GOL A 403

Chain	Residue
A	LEU40
A	ASP41
A	TYR75

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site_id	AC4
Number of Residues	6
Details	BINDING SITE FOR RESIDUE GOL A 404

Chain	Residue
A	ALA42
A	ARG46
A	PRO253
A	ARG256
A	HOH521
A	HOH541

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site_id	AC5
Number of Residues	3
Details	BINDING SITE FOR RESIDUE GOL A 405

Chain	Residue
A	ILE4
A	GLN169
A	PHE173

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site_id	AC6
Number of Residues	7
Details	BINDING SITE FOR RESIDUE 1PE A 406

Chain	Residue
A	ASP202
A	ALA205
A	PHE236
A	ILE247
A	SER248
A	GLN255
A	PHE258

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site_id	AC7
Number of Residues	6
Details	BINDING SITE FOR RESIDUE SO4 A 407

Chain	Residue
A	GLY13
A	VAL14
A	LEU15
A	ARG256
A	HOH505
A	HOH563

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site_id	AC8
Number of Residues	8
Details	BINDING SITE FOR RESIDUE SO4 A 408

Chain	Residue
A	GLY240
A	LEU241
A	THR242
A	THR243
A	LYS263
A	LEU272
A	HOH525
A	HOH548

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site_id	AC9
Number of Residues	3
Details	BINDING SITE FOR RESIDUE SO4 A 409

Chain	Residue
A	LYS56
A	ASN146
A	HIS147

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