PDB ligand accession: HBI
DrugBank: DB04400
PubChem: 119055;5288515;135398687;
ChEMBL: n/a
InChI Key: FEMXZDUTFRTWPE-DZSWIPIPSA-N
SMILES: C[C@H](O)[C@H](O)C1=NC2=C(NC1)NC(N)=NC2=O
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
SER | 71 | Phosphorylation | PyMOL_RFAA | ||
THR | 212 | Phosphorylation | PyMOL_RFAA | ||
SER | 326 | Phosphorylation | PyMOL_RFAA |