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4WCF

Trypanosoma brucei PTR1 in complex with inhibitor 9

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 Residues31
Detailsbinding site for residue NAP A 301
ChainResidue
AARG14
ATHR64
AASN93
AALA94
ASER95
ATHR126
ALEU159
ACYS160
AASP161
ATYR174
ALYS178
AILE15
APRO204
AGLY205
AVAL206
ASER207
ALEU208
A3KN302
AHOH421
AHOH436
AHOH438
AHOH466
ATYR34
AHOH495
AHOH501
AHIS35
AASN36
ASER37
AALA61
AASP62
ALEU63

site_idAC2
Number of Residues6
Detailsbinding site for residue 3KN A 302
ChainResidue
ASER95
APHE97
AASP161
ATYR174
APRO210
ANAP301

site_idAC3
Number of Residues4
Detailsbinding site for residue ACT A 303
ChainResidue
ALYS13
AARG14
AARG17
AHOH402

site_idAC4
Number of Residues30
Detailsbinding site for residue NAP B 301
ChainResidue
BARG14
BILE15
BTYR34
BHIS35
BASN36
BSER37
BALA61
BASP62
BLEU63
BTHR64
BASN93
BALA94
BSER95
BTHR126
BLEU159
BCYS160
BASP161
BTYR174
BLYS178
BPRO204
BGLY205
BSER207
BLEU208
B3KN302
BHOH432
BHOH437
BHOH451
BHOH452
BHOH468
BHOH492

site_idAC5
Number of Residues5
Detailsbinding site for residue 3KN B 302
ChainResidue
BSER95
BPHE97
BASP161
BTYR174
BNAP301

site_idAC6
Number of Residues29
Detailsbinding site for residue NAP C 301
ChainResidue
CLEU208
C3KN302
CHOH423
CHOH425
CHOH435
CHOH462
CARG14
CILE15
CTYR34
CHIS35
CASN36
CSER37
CALA61
CASP62
CLEU63
CTHR64
CASN93
CALA94
CSER95
CTHR126
CLEU159
CCYS160
CASP161
CTYR174
CLYS178
CPRO204
CGLY205
CVAL206
CSER207

site_idAC7
Number of Residues6
Detailsbinding site for residue 3KN C 302
ChainResidue
CSER95
CPHE97
CASP161
CTYR174
CPRO210
CNAP301

site_idAC8
Number of Residues5
Detailsbinding site for residue ACT C 303
ChainResidue
BTYR34
BVAL58
CVAL57
CVAL58
CHOH401

site_idAC9
Number of Residues6
Detailsbinding site for residue GOL C 304
ChainResidue
AASN65
AVAL120
AILE129
CASN65
CVAL120
CHOH461

site_idAD1
Number of Residues31
Detailsbinding site for residue NAP D 301
ChainResidue
DARG14
DILE15
DTYR34
DHIS35
DASN36
DSER37
DALA61
DASP62
DLEU63
DTHR64
DASN93
DALA94
DSER95
DTHR126
DLEU159
DCYS160
DASP161
DTYR174
DLYS178
DPRO204
DGLY205
DVAL206
DSER207
DLEU208
D3KN302
DHOH425
DHOH435
DHOH441
DHOH465
DHOH467
DHOH472

site_idAD2
Number of Residues6
Detailsbinding site for residue 3KN D 302
ChainResidue
DSER95
DPHE97
DASP161
DTYR174
DPRO210
DNAP301

site_idAD3
Number of Residues5
Detailsbinding site for residue GOL D 303
ChainResidue
CSER248
DASP239
DILE242
DPHE243
DSER246

Functional Information from PROSITE/UniProt
site_idPS00061
Number of Residues29
DetailsADH_SHORT Short-chain dehydrogenases/reductases family signature. DamvdqpcmaFslYNMGKHALvGLTqSAA
ChainResidueDetails
AASP161-ALA189
CASP161-ALA189
BASP161-ALA189

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PDB entries from 2024-09-04

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