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4LXW

L72V Epi-isozizaene synthase: Complex with Mg, inorganic pyrophosphate and benzyl triethyl ammonium cation

Functional Information from GO Data
ChainGOidnamespacecontents
A0010333molecular_functionterpene synthase activity
A0016829molecular_functionlyase activity
A0046872molecular_functionmetal ion binding
A0052680molecular_functionepi-isozizaene synthase activity
Functional Information from PDB Data
site_idAC1
Number of Residues7
DetailsBINDING SITE FOR RESIDUE MG A 700
ChainResidue
AASP99
AMG701
APOP703
AHOH801
AHOH803
AHOH806
AHOH817

site_idAC2
Number of Residues6
DetailsBINDING SITE FOR RESIDUE MG A 701
ChainResidue
APOP703
AHOH806
AHOH832
AHOH978
AASP99
AMG700

site_idAC3
Number of Residues5
DetailsBINDING SITE FOR RESIDUE MG A 702
ChainResidue
AASN240
ASER244
AGLU248
APOP703
AHOH821

site_idAC4
Number of Residues18
DetailsBINDING SITE FOR RESIDUE POP A 703
ChainResidue
AASP99
AARG194
AASN240
ASER244
ALYS247
AGLU248
AARG338
ATYR339
AMG700
AMG701
AMG702
ABTM704
AHOH803
AHOH806
AHOH817
AHOH819
AHOH821
AHOH832

site_idAC5
Number of Residues10
DetailsBINDING SITE FOR RESIDUE BTM A 704
ChainResidue
APHE95
APHE96
AASP99
ATHR197
APHE198
ATRP203
ATRP325
APHE332
ATYR339
APOP703

site_idAC6
Number of Residues7
DetailsBINDING SITE FOR RESIDUE SO4 A 705
ChainResidue
AARG163
AHIS164
AARG220
AARG226
AGOL706
AHOH901
AHOH1003

site_idAC7
Number of Residues6
DetailsBINDING SITE FOR RESIDUE GOL A 706
ChainResidue
AHIS164
ATRP201
AARG226
ASO4705
AHOH910
AHOH961

site_idAC8
Number of Residues7
DetailsBINDING SITE FOR RESIDUE GOL A 707
ChainResidue
AGLU43
AARG46
AGLY186
AVAL187
AGLU188
AGLU189
AHIS265

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues4
DetailsMotif: {"description":"DDXXD motif"}
ChainResidueDetails

site_idSWS_FT_FI2
Number of Residues5
DetailsBinding site: {}
ChainResidueDetails

Catalytic Information from CSA
site_idMCSA1
Number of Residues4
DetailsM-CSA 263
ChainResidueDetails
APHE95electrostatic stabiliser, polar/non-polar interaction, steric role
APHE96electrostatic stabiliser, polar/non-polar interaction, steric role
APHE198electrostatic stabiliser, polar/non-polar interaction, steric role
AARG338electrostatic stabiliser, hydrogen bond donor, promote heterolysis

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PDB entries from 2025-07-30

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