Ligand name: N-(1-adamantyl)-N'-(4-guanidinobenzyl)urea
PDB ligand accession: AGB
DrugBank: DB03782
PubChem: n/a
ChEMBL: n/a
InChI Key: YQPLKJCBEOVDBS-UHFFFAOYSA-N
SMILES: NC(N)=NC1=CC=C(CNC(=O)NC23CC4CC(CC(C4)C2)C3)C=C1
Drug action: n/a

List of small molecule binding-associated PTMs for P00749

Residue UniProt number Type of PTM AlphaFold3 models Rosetta models Chai-1 models
SER 323 Phosphorylation PyMOL_Chai1
THR 316 Phosphorylation PyMOL_Chai1
TYR 326 Phosphorylation PyMOL_Chai1
TYR 328 Phosphorylation PyMOL_Chai1
THR 335 Phosphorylation PyMOL_Chai1
SER 395 Phosphorylation PyMOL_Chai1