PDB ligand accession: BHP
DrugBank: DB04287
PubChem:
ChEMBL:
InChI Key: KWLUIYFCMHKLKY-NDEPHWFRSA-N
SMILES: [H]N([C@@H](CCC(O)=O)CC1=CC=C(OCC2=CC=CC=C2)C=C1)C(=O)CCCCCCC1=CC=CC=C1
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
TYR | 86 | Phosphorylation | PyMOL_Chai1 |