PDB ligand accession: L0I
DrugBank: DB08067
PubChem:
ChEMBL: n/a
InChI Key: LOLPPWBBNUVNQZ-UHFFFAOYSA-O
SMILES: O=C(NC1CC1)NC1=CNN=C1C1=NC2=CC=C(C[NH+]3CCOCC3)C=C2N1
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
TYR | 931 | Phosphorylation | PyMOL_RFAA | PyMOL_Chai1 | |
TYR | 934 | Phosphorylation | PyMOL_RFAA | PyMOL_Chai1 | |
SER | 936 | Phosphorylation | PyMOL_RFAA | ||
TYR | 940 | Phosphorylation | PyMOL_RFAA | PyMOL_Chai1 |