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4LUU

V329A Epi-isozizaene synthase: Complex with Mg, inorganic pyrophosphate and benzyl triethyl ammonium cation

Functional Information from GO Data
ChainGOidnamespacecontents
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
AHOH802
AHOH805
AHOH806

site_idAC2
Number of Residues6
DetailsBINDING SITE FOR RESIDUE MG A 701
ChainResidue
APOP703
AHOH802
AHOH803
AHOH804
AASP99
AMG700

site_idAC3
Number of Residues5
DetailsBINDING SITE FOR RESIDUE MG A 702
ChainResidue
AASN240
ASER244
AGLU248
APOP703
AHOH1045

site_idAC4
Number of Residues17
DetailsBINDING SITE FOR RESIDUE POP A 703
ChainResidue
AASP99
AARG194
AASN240
ASER244
ALYS247
AGLU248
AARG338
ATYR339
AMG700
AMG701
AMG702
ABTM704
AHOH801
AHOH802
AHOH805
AHOH831
AHOH1045

site_idAC5
Number of Residues9
DetailsBINDING SITE FOR RESIDUE BTM A 704
ChainResidue
ALEU72
APHE95
APHE96
AASP99
ATHR197
APHE198
AHIS333
ATYR339
APOP703

site_idAC6
Number of Residues7
DetailsBINDING SITE FOR RESIDUE SO4 A 705
ChainResidue
AARG163
AHIS164
AARG220
AARG226
AGOL707
AHOH855
AHOH1068

site_idAC7
Number of Residues4
DetailsBINDING SITE FOR RESIDUE SO4 A 706
ChainResidue
AGLY112
AARG116
AHOH869
AHOH909

site_idAC8
Number of Residues4
DetailsBINDING SITE FOR RESIDUE GOL A 707
ChainResidue
AHIS164
ATRP201
ASO4705
AHOH1163

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues5
DetailsBINDING:
ChainResidueDetails
AASN240
ASER244
AGLU248
AASP99
AASP103

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

221051

PDB entries from 2024-06-12

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