PDB ligand accession: 29S
DrugBank: DB06401
PubChem:
ChEMBL:
InChI Key: UCJGJABZCDBEDK-UHFFFAOYSA-N
SMILES: CC1=C(N(CC2=CC=C(OCCN3CCCCCC3)C=C2)C2=C1C=C(O)C=C2)C1=CC=C(O)C=C1
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
TYR | 537 | Phosphorylation | PyMOL_Chai1 | ||
TYR | 328 | Phosphorylation | PyMOL_Chai1 | ||
SER | 329 | Phosphorylation | PyMOL_RFAA |