PDB ligand accession: NAP
DrugBank: DB03461
PubChem: 5885;57525501;
ChEMBL:
InChI Key: XJLXINKUBYWONI-NNYOXOHSSA-N
SMILES: NC(=O)C1=CC=C[N+](=C1)[C@@H]1O[C@H](COP([O-])(=O)OP(O)(=O)OC[C@H]2O[C@H]([C@H](OP(O)(O)=O)[C@@H]2O)N2C=NC3=C2N=CN=C3N)[C@@H](O)[C@H]1O
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
SER | 21 | Phosphorylation | PyMOL_AF3 | PyMOL_RFAA | |
THR | 17 | Phosphorylation | PyMOL_AF3 | PyMOL_RFAA | |
THR | 207 | Phosphorylation | PyMOL_AF3 | PyMOL_RFAA | |
LYS | 59 | Acetylation | |||
SER | 11 | Phosphorylation | |||
LYS | 152 | Ubiquitination | |||
LYS | 187 | Ubiquitination | |||
THR | 121 | Phosphorylation |