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3T70

5'-Diphenyl Nucleoside Inhibitors of Plasmodium falciparum dUTPase

Functional Information from GO Data
ChainGOidnamespacecontents
A0000287molecular_functionmagnesium ion binding
A0004170molecular_functiondUTP diphosphatase activity
A0006226biological_processdUMP biosynthetic process
A0006260biological_processDNA replication
A0006399biological_processtRNA metabolic process
A0009117biological_processnucleotide metabolic process
A0016787molecular_functionhydrolase activity
A0042802molecular_functionidentical protein binding
A0046081biological_processdUTP catabolic process
A0046872molecular_functionmetal ion binding
B0000287molecular_functionmagnesium ion binding
B0004170molecular_functiondUTP diphosphatase activity
B0006226biological_processdUMP biosynthetic process
B0006260biological_processDNA replication
B0006399biological_processtRNA metabolic process
B0009117biological_processnucleotide metabolic process
B0016787molecular_functionhydrolase activity
B0042802molecular_functionidentical protein binding
B0046081biological_processdUTP catabolic process
B0046872molecular_functionmetal ion binding
C0000287molecular_functionmagnesium ion binding
C0004170molecular_functiondUTP diphosphatase activity
C0006226biological_processdUMP biosynthetic process
C0006260biological_processDNA replication
C0006399biological_processtRNA metabolic process
C0009117biological_processnucleotide metabolic process
C0016787molecular_functionhydrolase activity
C0042802molecular_functionidentical protein binding
C0046081biological_processdUTP catabolic process
C0046872molecular_functionmetal ion binding
Functional Information from PDB Data
site_idAC1
Number of Residues14
DetailsBINDING SITE FOR RESIDUE DU4 A 400
ChainResidue
APHE46
AHOH395
BSER92
BSER95
BLYS96
BHOH253
ALEU88
AASN103
AGLY106
AILE108
ATYR112
AILE117
AALA119
AHOH237

site_idAC2
Number of Residues9
DetailsBINDING SITE FOR RESIDUE SO4 A 182
ChainResidue
AARG91
ASER92
AGLN138
AHOH227
AHOH294
CDU4400
CHOH402
CHOH506
CHOH544

site_idAC3
Number of Residues14
DetailsBINDING SITE FOR RESIDUE DU4 B 400
ChainResidue
BPHE46
BLEU88
BASN103
BGLY106
BLEU107
BILE108
BTYR112
BILE116
BILE117
BALA119
BHOH236
CSER92
CSO4182
CHOH222

site_idAC4
Number of Residues8
DetailsBINDING SITE FOR RESIDUE SO4 B 182
ChainResidue
AHOH382
BARG91
BSER92
BGLN138
BHOH193
BHOH194
BHOH253
BHOH377

site_idAC5
Number of Residues6
DetailsBINDING SITE FOR RESIDUE SO4 B 183
ChainResidue
AASN61
AHOH245
BGLN126
BGLU127
BHOH204
BHOH428

site_idAC6
Number of Residues2
DetailsBINDING SITE FOR RESIDUE SO4 B 184
ChainResidue
BLYS132
BASN133

site_idAC7
Number of Residues14
DetailsBINDING SITE FOR RESIDUE DU4 C 400
ChainResidue
ASER92
ASO4182
CLEU88
CASN103
CGLY106
CLEU107
CTYR112
CILE116
CILE117
CALA119
CHOH278
CHOH402
CHOH530
CHOH545

site_idAC8
Number of Residues9
DetailsBINDING SITE FOR RESIDUE SO4 C 182
ChainResidue
BHOH359
BDU4400
CARG91
CSER92
CGLN138
CHOH222
CHOH268
CHOH512
CHOH514

site_idAC9
Number of Residues4
DetailsBINDING SITE FOR RESIDUE SO4 C 183
ChainResidue
CGLY111
CTYR112
CARG113
CARG160

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PDB entries from 2024-07-17

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