2W0S
Crystal structure of vaccinia virus thymidylate kinase bound to brivudin-5'-monophosphate
Functional Information from GO Data
| Chain | GOid | namespace | contents |
| A | 0000166 | molecular_function | nucleotide binding |
| A | 0004550 | molecular_function | nucleoside diphosphate kinase activity |
| A | 0004798 | molecular_function | dTMP kinase activity |
| A | 0005524 | molecular_function | ATP binding |
| A | 0006227 | biological_process | dUDP biosynthetic process |
| A | 0006233 | biological_process | dTDP biosynthetic process |
| A | 0006235 | biological_process | dTTP biosynthetic process |
| A | 0009165 | biological_process | nucleotide biosynthetic process |
| A | 0016301 | molecular_function | kinase activity |
| A | 0016740 | molecular_function | transferase activity |
| B | 0000166 | molecular_function | nucleotide binding |
| B | 0004550 | molecular_function | nucleoside diphosphate kinase activity |
| B | 0004798 | molecular_function | dTMP kinase activity |
| B | 0005524 | molecular_function | ATP binding |
| B | 0006227 | biological_process | dUDP biosynthetic process |
| B | 0006233 | biological_process | dTDP biosynthetic process |
| B | 0006235 | biological_process | dTTP biosynthetic process |
| B | 0009165 | biological_process | nucleotide biosynthetic process |
| B | 0016301 | molecular_function | kinase activity |
| B | 0016740 | molecular_function | transferase activity |
Functional Information from PDB Data
| site_id | AC1 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE MG B 1205 |
| Chain | Residue |
| B | THR18 |
| B | ASN37 |
| B | ASP92 |
| B | BVP1207 |
| site_id | AC2 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE MG A 1205 |
| Chain | Residue |
| A | THR18 |
| A | ASN37 |
| A | ASP92 |
| A | BVP1207 |
| site_id | AC3 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE MG A 1206 |
| Chain | Residue |
| A | GLU142 |
| A | GLU145 |
| A | BVP1207 |
| A | ASP13 |
| site_id | AC4 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE MG B 1206 |
| Chain | Residue |
| B | ASP13 |
| B | GLU142 |
| B | GLU145 |
| B | BVP1207 |
| site_id | AC5 |
| Number of Residues | 14 |
| Details | BINDING SITE FOR RESIDUE BVP A 1207 |
| Chain | Residue |
| A | ASP13 |
| A | PHE38 |
| A | ARG41 |
| A | VAL64 |
| A | ASN65 |
| A | PHE68 |
| A | ARG72 |
| A | ARG93 |
| A | GLY98 |
| A | TYR101 |
| A | LYS105 |
| A | TYR144 |
| A | MG1205 |
| A | MG1206 |
| site_id | AC6 |
| Number of Residues | 14 |
| Details | BINDING SITE FOR RESIDUE BVP B 1207 |
| Chain | Residue |
| B | ASP13 |
| B | PHE38 |
| B | ARG41 |
| B | ASN65 |
| B | PHE68 |
| B | ARG72 |
| B | ARG93 |
| B | GLY98 |
| B | TYR101 |
| B | ALA102 |
| B | LYS105 |
| B | TYR144 |
| B | MG1205 |
| B | MG1206 |
| site_id | AC7 |
| Number of Residues | 5 |
| Details | BINDING SITE FOR RESIDUE SO4 A 1208 |
| Chain | Residue |
| A | LYS14 |
| A | SER15 |
| A | GLY16 |
| A | LYS17 |
| A | THR18 |
| site_id | AC8 |
| Number of Residues | 5 |
| Details | BINDING SITE FOR RESIDUE SO4 B 1208 |
| Chain | Residue |
| B | LYS14 |
| B | SER15 |
| B | GLY16 |
| B | LYS17 |
| B | THR18 |
| site_id | AC9 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE BVP B 1209 |
| Chain | Residue |
| A | ASN60 |
| A | HIS62 |
| A | ILE63 |
| B | TRP73 |
Functional Information from PROSITE/UniProt
| site_id | PS01331 |
| Number of Residues | 13 |
| Details | THYMIDYLATE_KINASE Thymidylate kinase signature. IVDRYafSGvAYA |
| Chain | Residue | Details |
| A | ILE90-ALA102 |
