8PIE
Crystal structure of the human nucleoside diphosphate kinase B domain in complex with the product AT-8500 formed by catalysis of compound AT-9010
Functional Information from PROSITE/UniProt
| site_id | PS00469 |
| Number of Residues | 9 |
| Details | NDPK Nucleoside diphosphate kinase (NDPK) active site signature. NiiHGSDSV |
| Chain | Residue | Details |
| A | ASN119-VAL127 |
Functional Information from SwissProt/UniProt
| site_id | SWS_FT_FI1 |
| Number of Residues | 6 |
| Details | ACT_SITE: Pros-phosphohistidine intermediate => ECO:0000269|PubMed:1851158 |
| Chain | Residue | Details |
| A | HIP122 | |
| B | HIP122 | |
| C | HIP122 | |
| D | HIP122 | |
| E | HIP122 | |
| F | HIP122 |
| site_id | SWS_FT_FI2 |
| Number of Residues | 36 |
| Details | BINDING: BINDING => ECO:0000269|PubMed:19435876, ECO:0007744|PDB:3BBF |
| Chain | Residue | Details |
| A | LYS16 | |
| B | THR98 | |
| B | ARG109 | |
| B | ASN119 | |
| C | LYS16 | |
| C | PHE64 | |
| C | ARG92 | |
| C | THR98 | |
| C | ARG109 | |
| C | ASN119 | |
| D | LYS16 | |
| A | PHE64 | |
| D | PHE64 | |
| D | ARG92 | |
| D | THR98 | |
| D | ARG109 | |
| D | ASN119 | |
| E | LYS16 | |
| E | PHE64 | |
| E | ARG92 | |
| E | THR98 | |
| E | ARG109 | |
| A | ARG92 | |
| E | ASN119 | |
| F | LYS16 | |
| F | PHE64 | |
| F | ARG92 | |
| F | THR98 | |
| F | ARG109 | |
| F | ASN119 | |
| A | THR98 | |
| A | ARG109 | |
| A | ASN119 | |
| B | LYS16 | |
| B | PHE64 | |
| B | ARG92 |
