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CRYSTALLOGRAPHIC ANALYSIS OF THE COMPLEX BETWEEN TRIOSEPHOSPHATE ISOMERASE FROM TRYPANOSOMA CRUZI AND 3-(2-benzothiazolylthio)-1-propanesulfonic acid

Functional Information from GO Data
ChainGOidnamespacecontents
A0004807molecular_functiontriose-phosphate isomerase activity
A0005737cellular_componentcytoplasm
A0005777cellular_componentperoxisome
A0005829cellular_componentcytosol
A0006094biological_processgluconeogenesis
A0006096biological_processglycolytic process
A0016853molecular_functionisomerase activity
A0019563biological_processglycerol catabolic process
A0020015cellular_componentglycosome
A0046166biological_processglyceraldehyde-3-phosphate biosynthetic process
B0004807molecular_functiontriose-phosphate isomerase activity
B0005737cellular_componentcytoplasm
B0005777cellular_componentperoxisome
B0005829cellular_componentcytosol
B0006094biological_processgluconeogenesis
B0006096biological_processglycolytic process
B0016853molecular_functionisomerase activity
B0019563biological_processglycerol catabolic process
B0020015cellular_componentglycosome
B0046166biological_processglyceraldehyde-3-phosphate biosynthetic process
Functional Information from PDB Data
site_idAC1
Number of Residues7
DetailsBINDING SITE FOR RESIDUE SO4 A 501
ChainResidue
AARG193
AHOH592
AHOH594
AHOH633
AHOH635
BTHR175
BLYS177

site_idAC2
Number of Residues4
DetailsBINDING SITE FOR RESIDUE SO4 A 502
ChainResidue
AARG227
AHOH613
ASER3
ALYS4

site_idAC3
Number of Residues2
DetailsBINDING SITE FOR RESIDUE SO4 A 503
ChainResidue
AALA2
AARG227

site_idAC4
Number of Residues14
DetailsBINDING SITE FOR RESIDUE SO4 A 504
ChainResidue
ALYS14
AALA172
AILE173
AGLY174
AGLY213
ASER214
AGLY235
AGLY236
AHOH526
AHOH527
AHOH529
AHOH530
AHOH588
AHOH590

site_idAC5
Number of Residues6
DetailsBINDING SITE FOR RESIDUE SO4 B 505
ChainResidue
BGLY235
BGLY236
BHOH514
BHOH535
BHOH564
BHOH658

site_idAC6
Number of Residues2
DetailsBINDING SITE FOR RESIDUE SO4 A 506
ChainResidue
AARG196
BLYS177

site_idAC7
Number of Residues5
DetailsBINDING SITE FOR RESIDUE SO4 B 507
ChainResidue
BARG55
BARG227
BHOH576
BHOH606
BHOH627

site_idAC8
Number of Residues6
DetailsBINDING SITE FOR RESIDUE BTS B 401
ChainResidue
AARG71
AALA141
ATHR146
ALEU190
BTYR102
BHOH590

Functional Information from PROSITE/UniProt
site_idPS00171
Number of Residues11
DetailsTIM_1 Triosephosphate isomerase active site. AYEPVWAIGTG
ChainResidueDetails
AALA166-GLY176

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues2
DetailsACT_SITE: Electrophile => ECO:0000250
ChainResidueDetails
AHIS96
BHIS96

site_idSWS_FT_FI2
Number of Residues2
DetailsACT_SITE: Proton acceptor => ECO:0000250
ChainResidueDetails
AGLU168
BGLU168

site_idSWS_FT_FI3
Number of Residues4
DetailsBINDING: BINDING => ECO:0000250
ChainResidueDetails
AASN12
ALYS14
BASN12
BLYS14

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PDB entries from 2024-04-17

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