7XEF

Crystal Structure of the Y53F/N55A mutant of LEH complexed with (R)-(1-benzyl-3-phenylpyrrolidin-3-yl)methanol

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
C	0016787	molecular_function	hydrolase activity
C	0018744	molecular_function	limonene-1,2-epoxide hydrolase activity
D	0016787	molecular_function	hydrolase activity
D	0018744	molecular_function	limonene-1,2-epoxide hydrolase activity

Functional Information from SwissProt/UniProt

site_id	SWS_FT_FI1
Number of Residues	4
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	4
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	PHE53	electrostatic stabiliser
A	ALA55	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	PHE53	electrostatic stabiliser
B	ALA55	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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site_id	MCSA3
Number of Residues	5
Details	M-CSA 644

Chain	Residue	Details
C	PHE53	electrostatic stabiliser
C	ALA55	electrostatic stabiliser
C	ARG99	electrostatic stabiliser, proton acceptor, proton donor, proton relay
C	ASP101	proton acceptor, proton donor
C	ASP132	activator, proton acceptor, proton donor

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site_id	MCSA4
Number of Residues	5
Details	M-CSA 644

Chain	Residue	Details
D	PHE53	electrostatic stabiliser
D	ALA55	electrostatic stabiliser
D	ARG99	electrostatic stabiliser, proton acceptor, proton donor, proton relay
D	ASP101	proton acceptor, proton donor
D	ASP132	activator, proton acceptor, proton donor

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