PDB ligand accession: 1KX
DrugBank: DB01048
PubChem:
ChEMBL:
InChI Key: MCGSCOLBFJQGHM-SCZZXKLOSA-N
SMILES: NC1=NC2=C(N=CN2[C@@H]2C[C@H](CO)C=C2)C(NC2CC2)=N1
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
TYR | 123 | Phosphorylation | PyMOL_Chai1 | ||
TYR | 108 | Phosphorylation | PyMOL_Chai1 | ||
TYR | 109 | Phosphorylation | PyMOL_Chai1 | ||
TYR | 31 | Phosphorylation | PyMOL_Chai1 | ||
TYR | 33 | Phosphorylation | PyMOL_Chai1 | ||
THR | 34 | Phosphorylation | PyMOL_Chai1 | ||
THR | 97 | Phosphorylation | PyMOL_Chai1 | ||
LYS | 145 | Ubiquitination |