5GKW

crystal structure of SZ529 complex with (R,R)-cyclopentanediol

Functional Information from GO Data

Chain	GOid	namespace	contents
A	0016787	molecular_function	hydrolase activity
A	0018744	molecular_function	limonene-1,2-epoxide hydrolase activity
B	0016787	molecular_function	hydrolase activity
B	0018744	molecular_function	limonene-1,2-epoxide hydrolase activity

Functional Information from PDB Data

site_id	AC1
Number of Residues	7
Details	binding site for residue 6VV A 201

Chain	Residue
A	TYR53
A	ASN55
A	LEU74
A	ARG99
A	ASP101
A	ILE116
A	ASP132

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Functional Information from SwissProt/UniProt

site_id	SWS_FT_FI1
Number of Residues	2
Details	Active site: {"description":"Proton donor","evidences":[{"evidenceCode":"ECO:0000305"}]}

Chain

Residue

Details

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site_id	SWS_FT_FI2
Number of Residues	2
Details	Active site: {"description":"Proton acceptor","evidences":[{"evidenceCode":"ECO:0000305"}]}

Chain

Residue

Details

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Catalytic Information from CSA

site_id	MCSA1
Number of Residues	5
Details	M-CSA 644

Chain	Residue	Details
A	TYR53	electrostatic stabiliser
A	ASN55	electrostatic stabiliser
A	ARG99	electrostatic stabiliser, proton acceptor, proton donor, proton relay
A	ASP101	proton acceptor, proton donor
A	ASP132	activator, proton acceptor, proton donor

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site_id	MCSA2
Number of Residues	5
Details	M-CSA 644

Chain	Residue	Details
B	TYR53	electrostatic stabiliser
B	ASN55	electrostatic stabiliser
B	ARG99	electrostatic stabiliser, proton acceptor, proton donor, proton relay
B	ASP101	proton acceptor, proton donor
B	ASP132	activator, proton acceptor, proton donor

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