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5CK6

Crystal structure of SZ348 in complex with cyclopentene oxide

Functional Information from GO Data
ChainGOidnamespacecontents
A0016787molecular_functionhydrolase activity
A0018744molecular_functionlimonene-1,2-epoxide hydrolase activity
B0016787molecular_functionhydrolase activity
B0018744molecular_functionlimonene-1,2-epoxide hydrolase activity
Functional Information from PDB Data
site_idAC1
Number of Residues4
Detailsbinding site for residue 3ZS A 201
ChainResidue
AASN55
ALEU103
APHE134
AHOH301

site_idAC2
Number of Residues6
Detailsbinding site for residue K A 202
ChainResidue
BASN92
AALA16
AALA17
AALA19
ASER21
AILE88

site_idAC3
Number of Residues1
Detailsbinding site for residue NI A 203
ChainResidue
AHIS-2

site_idAC4
Number of Residues1
Detailsbinding site for residue NI A 204
ChainResidue
AHIS-3

site_idAC5
Number of Residues7
Detailsbinding site for residue K A 205
ChainResidue
AASN92
BALA16
BALA17
BALA19
BSER21
BGLU25
BILE88

site_idAC6
Number of Residues6
Detailsbinding site for residue 3ZS B 201
ChainResidue
BASN55
BMET78
BTYR80
BASP101
BLEU103
BHOH303

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues2
DetailsACT_SITE: Proton donor => ECO:0000305
ChainResidueDetails
AASP101
BASP101

site_idSWS_FT_FI2
Number of Residues2
DetailsACT_SITE: Proton acceptor => ECO:0000305
ChainResidueDetails
AASP132
BASP132

Catalytic Information from CSA
site_idMCSA1
Number of Residues5
DetailsM-CSA 644
ChainResidueDetails
ATYR53electrostatic stabiliser
AASN55electrostatic stabiliser
AARG99electrostatic stabiliser, proton acceptor, proton donor, proton relay
AASP101proton acceptor, proton donor
AASP132activator, proton acceptor, proton donor

site_idMCSA2
Number of Residues5
DetailsM-CSA 644
ChainResidueDetails
BTYR53electrostatic stabiliser
BASN55electrostatic stabiliser
BARG99electrostatic stabiliser, proton acceptor, proton donor, proton relay
BASP101proton acceptor, proton donor
BASP132activator, proton acceptor, proton donor

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PDB entries from 2025-02-12

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