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2YHU

Trypanosoma brucei PTR1 in complex with inhibitor WHF30

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 Residues28
DetailsBINDING SITE FOR RESIDUE NDP A 301
ChainResidue
AARG14
ATHR64
AASN93
AALA94
ASER95
ATHR126
ALEU159
ACYS160
ATYR174
ALYS178
APRO204
AILE15
AGLY205
ASER207
ALEU208
AWHF302
AHOH2003
AHOH2004
AHOH2006
AHOH2016
AHOH2104
ATYR34
AHIS35
AASN36
ASER37
AALA61
AASP62
ALEU63

site_idAC2
Number of Residues6
DetailsBINDING SITE FOR RESIDUE WHF A 302
ChainResidue
ASER95
APHE97
ATYR174
APRO210
ATRP221
ANDP301

site_idAC3
Number of Residues4
DetailsBINDING SITE FOR RESIDUE ACT B 1269
ChainResidue
BTYR34
BVAL58
CVAL57
CVAL58

site_idAC4
Number of Residues28
DetailsBINDING SITE FOR RESIDUE NDP B 301
ChainResidue
BARG14
BILE15
BTYR34
BHIS35
BASN36
BSER37
BALA61
BASP62
BLEU63
BTHR64
BASN93
BALA94
BSER95
BTHR126
BLEU159
BCYS160
BTYR174
BLYS178
BPRO204
BGLY205
BVAL206
BSER207
BLEU208
BWHF302
BHOH2003
BHOH2004
BHOH2018
BHOH2099

site_idAC5
Number of Residues8
DetailsBINDING SITE FOR RESIDUE WHF B 302
ChainResidue
BSER95
BPHE97
BTYR174
BVAL206
BPRO210
BTRP221
BNDP301
BHOH2069

site_idAC6
Number of Residues24
DetailsBINDING SITE FOR RESIDUE NDP C 301
ChainResidue
CARG14
CILE15
CTYR34
CHIS35
CASN36
CSER37
CALA61
CASP62
CLEU63
CTHR64
CASN93
CALA94
CSER95
CTHR126
CLEU159
CCYS160
CTYR174
CLYS178
CPRO204
CGLY205
CSER207
CLEU208
CWHF302
CHOH2002

site_idAC7
Number of Residues8
DetailsBINDING SITE FOR RESIDUE WHF C 302
ChainResidue
CPHE97
CTYR174
CVAL206
CPRO210
CMET213
CTRP221
CNDP301
CSER95

site_idAC8
Number of Residues28
DetailsBINDING SITE FOR RESIDUE NDP 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
DWHF302
DHOH2003
DHOH2004
DHOH2015
DHOH2078

site_idAC9
Number of Residues9
DetailsBINDING SITE FOR RESIDUE WHF D 302
ChainResidue
DSER95
DPHE97
DTYR174
DVAL206
DPRO210
DMET213
DTRP221
DNDP301
DHOH2060

site_idBC1
Number of Residues5
DetailsBINDING SITE FOR RESIDUE ACT D 1269
ChainResidue
BMET136
DTHR100
DPRO101
DGLN104
DGLN119

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

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PDB entries from 2024-09-04

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