PDB ligand accession: MI1
DrugBank: DB08895
PubChem:
ChEMBL:
InChI Key: UJLAWZDWDVHWOW-YPMHNXCESA-N
SMILES: C[C@@H]1CCN(C[C@@H]1N(C)C1=NC=NC2=C1C=CN2)C(=O)CC#N
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
TYR | 931 | Phosphorylation | PyMOL_Chai1 | ||
TYR | 934 | Phosphorylation | PyMOL_RFAA | PyMOL_Chai1 | |
SER | 936 | Phosphorylation | PyMOL_Chai1 | ||
TYR | 940 | Phosphorylation | PyMOL_Chai1 |