PDB ligand accession: K01
DrugBank: DB08032
PubChem:
ChEMBL:
InChI Key: NZTHBWHANVWSRX-UHFFFAOYSA-N
SMILES: CCN(CC)C(=O)C1=C(NC(=O)C2=CC=CS2)SC2=C1CCCC2
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
SER | 120 | Phosphorylation | PyMOL_RFAA | ||
TYR | 125 | Phosphorylation | PyMOL_RFAA | PyMOL_Chai1 | |
THR | 126 | Phosphorylation | PyMOL_RFAA | ||
TYR | 211 | Phosphorylation | PyMOL_RFAA | PyMOL_Chai1 | |
TYR | 231 | Phosphorylation | PyMOL_RFAA | PyMOL_Chai1 | |
THR | 222 | Phosphorylation | PyMOL_RFAA | ||
LYS | 216 | Ubiquitination |