PDB ligand accession: IBP
DrugBank: DB09213
PubChem:
ChEMBL:
InChI Key: HEFNNWSXXWATRW-JTQLQIEISA-N
SMILES: CC(C)CC1=CC=C(C=C1)[C@H](C)C(O)=O
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
THR | 117 | Phosphorylation | PyMOL_Chai1 | ||
THR | 88 | Phosphorylation | PyMOL_Chai1 | ||
THR | 93 | Phosphorylation | PyMOL_RFAA |