4AON

Conformational dynamics of aspartate alpha-decarboxylase active site revealed by protein-ligand complexes: 1-methyl-L-aspartate complex

Functional Information from GO Data

Chain	GOid	namespace	contents
A	0004068	molecular_function	aspartate 1-decarboxylase activity
A	0006523	biological_process	alanine biosynthetic process
B	0004068	molecular_function	aspartate 1-decarboxylase activity
B	0006523	biological_process	alanine biosynthetic process
D	0004068	molecular_function	aspartate 1-decarboxylase activity
D	0006523	biological_process	alanine biosynthetic process
E	0004068	molecular_function	aspartate 1-decarboxylase activity
E	0006523	biological_process	alanine biosynthetic process

Functional Information from PDB Data

site_id	AC1
Number of Residues	13
Details	BINDING SITE FOR RESIDUE GLU B 1123

Chain	Residue
A	TYR22
D	HIS11
E	TRP47
E	ARG54
E	ILE86
A	GLY24
B	PYR25
B	THR57
B	TYR58
B	GLY73
B	ALA74
B	ALA75
D	LYS9

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site_id	AC2
Number of Residues	13
Details	BINDING SITE FOR RESIDUE GLU E 1116

Chain	Residue
A	LYS9
A	HIS11
B	TRP47
B	ARG54
B	ILE86
D	TYR22
E	PYR25
E	THR57
E	TYR58
E	ASN72
E	GLY73
E	ALA74
E	ALA75

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Functional Information from SwissProt/UniProt

site_id	SWS_FT_FI1
Number of Residues	2
Details	Active site: {"description":"Proton donor"}

Chain

Residue

Details

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site_id	SWS_FT_FI2
Number of Residues	6
Details	Binding site: {"evidences":[{"evidenceCode":"ECO:0000250"}]}

Chain

Residue

Details

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Catalytic Information from CSA

site_id	MCSA1
Number of Residues	1
Details	M-CSA 409

Chain	Residue	Details
B	ALA62	activator, increase nucleophilicity, proton acceptor, proton donor

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site_id	MCSA2
Number of Residues	1
Details	M-CSA 409

Chain	Residue	Details
D	HIS21	activator, increase nucleophilicity, proton acceptor, proton donor

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