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5JDC

Trypanosoma brucei PTR1 in complex with inhibitor NP-13 (Hesperetin)

Functional Information from GO Data
ChainGOidnamespacecontents
A0000166molecular_functionnucleotide binding
A0016491molecular_functionoxidoreductase activity
A0047040molecular_functionpteridine reductase activity
B0000166molecular_functionnucleotide binding
B0016491molecular_functionoxidoreductase activity
B0047040molecular_functionpteridine reductase activity
C0000166molecular_functionnucleotide binding
C0016491molecular_functionoxidoreductase activity
C0047040molecular_functionpteridine reductase activity
D0000166molecular_functionnucleotide binding
D0016491molecular_functionoxidoreductase activity
D0047040molecular_functionpteridine reductase activity
Functional Information from PDB Data
site_idAC1
Number of Residues26
Detailsbinding site for residue NAP A 301
ChainResidue
AARG14
ATHR64
AASN93
AALA94
ASER95
ATHR126
ALEU159
ACYS160
ATYR174
ALYS178
AGLY205
AILE15
ASER207
ALEU208
A6JP302
AHOH402
AHOH407
AHOH414
AHOH447
ATYR34
AHIS35
AASN36
ASER37
AALA61
AASP62
ALEU63

site_idAC2
Number of Residues15
Detailsbinding site for residue 6JP A 302
ChainResidue
AARG14
ASER95
APHE97
AASP161
AMET163
AGLN166
ACSX168
ATYR174
ALEU208
ALEU209
APRO210
ATRP221
ANAP301
AHOH451
DHIS267

site_idAC3
Number of Residues3
Detailsbinding site for residue ACT A 303
ChainResidue
ALYS13
AARG14
AHOH416

site_idAC4
Number of Residues28
Detailsbinding site for residue NAP B 301
ChainResidue
BARG14
BILE15
BTYR34
BHIS35
BASN36
BSER37
BALA61
BASP62
BLEU63
BTHR64
BASN93
BALA94
BSER95
BTHR126
BLEU159
BCYS160
BTYR174
BLYS178
BPRO204
BGLY205
BSER207
BLEU208
B6JP302
BHOH408
BHOH420
BHOH436
BHOH444
BHOH476

site_idAC5
Number of Residues13
Detailsbinding site for residue 6JP B 302
ChainResidue
BARG14
BSER95
BPHE97
BASP161
BMET163
BGLN166
BPRO167
BCSX168
BTYR174
BLEU208
BPRO210
BNAP301
BHOH466

site_idAC6
Number of Residues26
Detailsbinding site for residue NAP C 301
ChainResidue
CLEU159
CCYS160
CASP161
CTYR174
CLYS178
CPRO204
CGLY205
CVAL206
CSER207
C6JP302
CHOH421
CHOH425
CGLY10
CARG14
CILE15
CTYR34
CHIS35
CASN36
CSER37
CASP62
CLEU63
CTHR64
CASN93
CALA94
CSER95
CTHR126

site_idAC7
Number of Residues12
Detailsbinding site for residue 6JP C 302
ChainResidue
BHIS267
CARG14
CSER95
CPHE97
CASP161
CMET163
CGLN166
CCSX168
CTYR174
CLEU209
CPRO210
CNAP301

site_idAC8
Number of Residues4
Detailsbinding site for residue ACT C 303
ChainResidue
BTYR34
BVAL58
CVAL57
CVAL58

site_idAC9
Number of Residues8
Detailsbinding site for residue GOL C 304
ChainResidue
BALA45
BASP46
BVAL57
BVAL58
CTYR34
CVAL58
COCS59
CGLN60

site_idAD1
Number of Residues27
Detailsbinding site for residue NAP D 301
ChainResidue
DARG14
DILE15
DTYR34
DHIS35
DASN36
DSER37
DALA61
DASP62
DLEU63
DTHR64
DASN93
DALA94
DSER95
DTHR126
DLEU159
DCYS160
DTYR174
DLYS178
DPRO204
DGLY205
DVAL206
DSER207
DLEU208
D6JP302
DHOH408
DHOH422
DHOH437

site_idAD2
Number of Residues14
Detailsbinding site for residue 6JP D 302
ChainResidue
AHIS267
DARG14
DSER95
DPHE97
DASP161
DMET163
DGLN166
DCSX168
DTYR174
DLEU208
DLEU209
DPRO210
DNAP301
DHOH415

Functional Information from PROSITE/UniProt
site_idPS00061
Number of Residues29
DetailsADH_SHORT Short-chain dehydrogenases/reductases family signature. DamvdqpcmaFslYNMGKHALvGLTqSAA
ChainResidueDetails
CASP161-ALA189
AASP161-ALA189

218853

PDB entries from 2024-04-24

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