Ligand name: N-[(1S)-2-amino-1-phenylethyl]-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)thiophene-2-carboxamide
PDB ligand accession: G95
DrugBank: DB07812
PubChem: 24963048
ChEMBL: n/a
InChI Key: TWYNGDRSMHRPSY-MRXNPFEDSA-N
SMILES: [H][C@](CN)(NC(=O)C1=CC=C(S1)C1=C2C=CNC2=NC=C1)C1=CC=CC=C1
Drug action: n/a

List of small molecule binding-associated PTMs for P49841

Residue	UniProt number	Type of PTM	AlphaFold3 models	Rosetta models	Chai-1 models
THR	313	O-linked_glycosylation
TYR	177	Phosphorylation
TYR	178	Phosphorylation
THR	313	Phosphorylation
TYR	438	Phosphorylation
THR	444	Phosphorylation
LYS	277	Ubiquitination
THR	7	Phosphorylation		PyMOL_RFAA
THR	8	Phosphorylation		PyMOL_RFAA
SER	9	Phosphorylation		PyMOL_RFAA