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4OKM

Selinadiene Synthase apo and in complex with diphosphate

Functional Information from GO Data
ChainGOidnamespacecontents
A0000287molecular_functionmagnesium ion binding
A0010333molecular_functionterpene synthase activity
A0016114biological_processterpenoid biosynthetic process
A0016829molecular_functionlyase activity
A0046872molecular_functionmetal ion binding
B0000287molecular_functionmagnesium ion binding
B0010333molecular_functionterpene synthase activity
B0016114biological_processterpenoid biosynthetic process
B0016829molecular_functionlyase activity
B0046872molecular_functionmetal ion binding
C0000287molecular_functionmagnesium ion binding
C0010333molecular_functionterpene synthase activity
C0016114biological_processterpenoid biosynthetic process
C0016829molecular_functionlyase activity
C0046872molecular_functionmetal ion binding
D0000287molecular_functionmagnesium ion binding
D0010333molecular_functionterpene synthase activity
D0016114biological_processterpenoid biosynthetic process
D0016829molecular_functionlyase activity
D0046872molecular_functionmetal ion binding
Functional Information from PDB Data
site_idAC1
Number of Residues6
DetailsBINDING SITE FOR RESIDUE MG A 901
ChainResidue
AGLU87
AMG902
APPV904
AHOH1072
AHOH1202
AHOH1204

site_idAC2
Number of Residues7
DetailsBINDING SITE FOR RESIDUE MG A 902
ChainResidue
APPV904
AHOH1125
AHOH1191
AHOH1203
AASP82
AGLU87
AMG901

site_idAC3
Number of Residues5
DetailsBINDING SITE FOR RESIDUE MG A 903
ChainResidue
AASN224
ASER228
AGLU232
APPV904
AHOH1196

site_idAC4
Number of Residues19
DetailsBINDING SITE FOR RESIDUE PPV A 904
ChainResidue
APHE79
AASP82
AGLU87
AARG178
AASN224
ASER228
ALYS231
AGLU232
AARG310
ATYR311
AMG901
AMG902
AMG903
AHOH1020
AHOH1072
AHOH1191
AHOH1202
AHOH1203
AHOH1204

site_idAC5
Number of Residues6
DetailsBINDING SITE FOR RESIDUE MG B 901
ChainResidue
BGLU87
BMG902
BPPV904
BHOH1213
BHOH1218
BHOH1230

site_idAC6
Number of Residues7
DetailsBINDING SITE FOR RESIDUE MG B 902
ChainResidue
BASP82
BGLU87
BMG901
BPPV904
BHOH1003
BHOH1017
BHOH1107

site_idAC7
Number of Residues5
DetailsBINDING SITE FOR RESIDUE MG B 903
ChainResidue
BASN224
BSER228
BGLU232
BPPV904
BHOH1236

site_idAC8
Number of Residues19
DetailsBINDING SITE FOR RESIDUE PPV B 904
ChainResidue
BASP82
BGLU87
BARG178
BASN224
BSER228
BLYS231
BGLU232
BARG310
BTYR311
BMG901
BMG902
BMG903
BHOH1017
BHOH1047
BHOH1107
BHOH1213
BHOH1218
BHOH1230
BHOH1236

site_idAC9
Number of Residues7
DetailsBINDING SITE FOR RESIDUE MG C 901
ChainResidue
CASP82
CGLU87
CMG902
CPPV904
CHOH1010
CHOH1186
CHOH1206

site_idBC1
Number of Residues7
DetailsBINDING SITE FOR RESIDUE MG C 902
ChainResidue
CASP82
CGLU87
CMG901
CPPV904
CHOH1023
CHOH1086
CHOH1205

site_idBC2
Number of Residues5
DetailsBINDING SITE FOR RESIDUE MG C 903
ChainResidue
CASN224
CSER228
CGLU232
CPPV904
CHOH1202

site_idBC3
Number of Residues19
DetailsBINDING SITE FOR RESIDUE PPV C 904
ChainResidue
CGLU232
CARG310
CTYR311
CMG901
CMG902
CMG903
CHOH1010
CHOH1016
CHOH1086
CHOH1186
CHOH1202
CHOH1205
CHOH1206
CASP82
CGLU87
CARG178
CASN224
CSER228
CLYS231

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues28
DetailsBINDING: BINDING => ECO:0000269|PubMed:24890698, ECO:0007744|PDB:4OKM, ECO:0007744|PDB:4OKZ
ChainResidueDetails
ASER228
AGLU232
AARG310
BASP82
BGLU87
BARG178
BASN224
BSER228
BGLU232
BARG310
CASP82
CGLU87
CARG178
CASN224
CSER228
CGLU232
CARG310
DASP82
DGLU87
DARG178
DASN224
DSER228
DGLU232
DARG310
AASP82
AGLU87
AARG178
AASN224

site_idSWS_FT_FI2
Number of Residues4
DetailsBINDING: BINDING => ECO:0000269|PubMed:24890698, ECO:0007744|PDB:4OKZ
ChainResidueDetails
ALYS231
BLYS231
CLYS231
DLYS231

site_idSWS_FT_FI3
Number of Residues8
DetailsSITE: Plays a critical role in the stabilization of intermediate cation => ECO:0000269|PubMed:24890698
ChainResidueDetails
APHE55
APHE79
BPHE55
BPHE79
CPHE55
CPHE79
DPHE55
DPHE79

site_idSWS_FT_FI4
Number of Residues8
DetailsSITE: Plays a critical role for substrate recognition => ECO:0000269|PubMed:24890698
ChainResidueDetails
CASP83
CGLU159
DASP83
DGLU159
AGLU159
BASP83
BGLU159
AASP83

site_idSWS_FT_FI5
Number of Residues4
DetailsSITE: Plays a critical role for abstraction of the pyrophosphate group => ECO:0000269|PubMed:24890698
ChainResidueDetails
AGLY182
BGLY182
CGLY182
DGLY182

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PDB entries from 2024-06-12

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