3T64
5'-Diphenyl Nucleoside Inhibitors of Plasmodium falciparum dUTPase
Functional Information from GO Data
| Chain | GOid | namespace | contents |
| A | 0000287 | molecular_function | magnesium ion binding |
| A | 0004170 | molecular_function | dUTP diphosphatase activity |
| A | 0006226 | biological_process | dUMP biosynthetic process |
| A | 0006260 | biological_process | DNA replication |
| A | 0006399 | biological_process | tRNA metabolic process |
| A | 0009117 | biological_process | nucleotide metabolic process |
| A | 0016787 | molecular_function | hydrolase activity |
| A | 0042802 | molecular_function | identical protein binding |
| A | 0046081 | biological_process | dUTP catabolic process |
| A | 0046872 | molecular_function | metal ion binding |
| B | 0000287 | molecular_function | magnesium ion binding |
| B | 0004170 | molecular_function | dUTP diphosphatase activity |
| B | 0006226 | biological_process | dUMP biosynthetic process |
| B | 0006260 | biological_process | DNA replication |
| B | 0006399 | biological_process | tRNA metabolic process |
| B | 0009117 | biological_process | nucleotide metabolic process |
| B | 0016787 | molecular_function | hydrolase activity |
| B | 0042802 | molecular_function | identical protein binding |
| B | 0046081 | biological_process | dUTP catabolic process |
| B | 0046872 | molecular_function | metal ion binding |
| C | 0000287 | molecular_function | magnesium ion binding |
| C | 0004170 | molecular_function | dUTP diphosphatase activity |
| C | 0006226 | biological_process | dUMP biosynthetic process |
| C | 0006260 | biological_process | DNA replication |
| C | 0006399 | biological_process | tRNA metabolic process |
| C | 0009117 | biological_process | nucleotide metabolic process |
| C | 0016787 | molecular_function | hydrolase activity |
| C | 0042802 | molecular_function | identical protein binding |
| C | 0046081 | biological_process | dUTP catabolic process |
| C | 0046872 | molecular_function | metal ion binding |
Functional Information from PDB Data
| site_id | AC1 |
| Number of Residues | 15 |
| Details | BINDING SITE FOR RESIDUE DU3 A 201 |
| Chain | Residue |
| A | PHE46 |
| A | ALA119 |
| A | HOH343 |
| A | HOH369 |
| B | SER92 |
| B | SER95 |
| B | LYS96 |
| A | LEU88 |
| A | ASN103 |
| A | GLY106 |
| A | LEU107 |
| A | ILE108 |
| A | TYR112 |
| A | ILE116 |
| A | ILE117 |
| site_id | AC2 |
| Number of Residues | 8 |
| Details | BINDING SITE FOR RESIDUE SO4 A 202 |
| Chain | Residue |
| A | ARG91 |
| A | SER92 |
| A | GLN138 |
| A | HOH333 |
| A | HOH379 |
| C | DU3201 |
| C | HOH305 |
| C | HOH344 |
| site_id | AC3 |
| Number of Residues | 15 |
| Details | BINDING SITE FOR RESIDUE DU3 B 201 |
| Chain | Residue |
| B | PHE46 |
| B | LEU88 |
| B | ASN103 |
| B | GLY106 |
| B | LEU107 |
| B | ILE108 |
| B | TYR112 |
| B | ILE116 |
| B | ILE117 |
| B | ALA119 |
| B | HOH335 |
| B | HOH365 |
| C | SER92 |
| C | SO4202 |
| C | HOH355 |
| site_id | AC4 |
| Number of Residues | 7 |
| Details | BINDING SITE FOR RESIDUE SO4 B 202 |
| Chain | Residue |
| A | HOH369 |
| B | ARG91 |
| B | SER92 |
| B | GLN138 |
| B | HOH305 |
| B | HOH311 |
| B | HOH312 |
| site_id | AC5 |
| Number of Residues | 14 |
| Details | BINDING SITE FOR RESIDUE DU3 C 201 |
| Chain | Residue |
| A | SER92 |
| A | SO4202 |
| C | LEU88 |
| C | ASN103 |
| C | GLY106 |
| C | LEU107 |
| C | TYR112 |
| C | ILE116 |
| C | ILE117 |
| C | ALA119 |
| C | HOH330 |
| C | HOH345 |
| C | HOH348 |
| C | HOH382 |
| site_id | AC6 |
| Number of Residues | 6 |
| Details | BINDING SITE FOR RESIDUE SO4 C 202 |
| Chain | Residue |
| B | DU3201 |
| C | SER92 |
| C | GLN138 |
| C | HOH312 |
| C | HOH314 |
| C | HOH355 |
| site_id | AC7 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE SO4 C 203 |
| Chain | Residue |
| C | GLY111 |
| C | TYR112 |
| C | ARG113 |
| C | ARG160 |






