PDB ligand accession: NRK
DrugBank: DB11951
PubChem:
ChEMBL:
InChI Key: MUGXRYIUWFITCP-PGRDOPGGSA-N
SMILES: CC1=NC=C(OC[C@]2(C[C@H]2C(=O)NC2=NC=C(F)C=C2)C2=CC=CC(F)=C2)C(C)=N1
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
TYR | 317 | Phosphorylation | PyMOL_Chai1 | ||
SER | 321 | Phosphorylation | PyMOL_RFAA | ||
TYR | 132 | Phosphorylation | PyMOL_Chai1 | ||
THR | 135 | Phosphorylation | PyMOL_RFAA | ||
SER | 137 | Phosphorylation | PyMOL_RFAA | ||
SER | 139 | Phosphorylation | PyMOL_RFAA | ||
SER | 141 | Phosphorylation | PyMOL_RFAA |