PDB ligand accession: 3TP
DrugBank: DB07067
PubChem:
ChEMBL:
InChI Key: SQCDMTZMCHZYGO-FZMZJTMJSA-N
SMILES: [H][C@@](N)(C(=O)N1CCCC1)[C@]([H])(C)C1=NC(=NO1)C1=CC=C(C=C1)S(C)(=O)=O
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
SER | 630 | Phosphorylation | PyMOL_RFAA | ||
TYR | 631 | Phosphorylation | PyMOL_RFAA | PyMOL_Chai1 |