Ligand name: 2-Phenylheme
PDB ligand accession: 2FH
DrugBank: DB03906
PubChem: n/a
ChEMBL: n/a
InChI Key: RHCCVTLDOSIQDM-NULOGZTHSA-L
SMILES: CC1=C(C=C)C2=CC3=[N+]4C(=CC5=C(C)C(CCC(O)=O)=C6N5[Fe]44N2C1=CC1=[N+]4C(C(CCC(O)=O)=C1C)=C6C1=CC=CC=C1)C(C=C)=C3C
Drug action: n/a

List of small molecule binding-associated PTMs for P09601

Residue	UniProt number	Type of PTM	AlphaFold3 models	Rosetta models	Chai-1 models
LYS	18	Acetylation			PyMOL_Chai1
LYS	39	Acetylation			PyMOL_Chai1
LYS	18	Malonylation
LYS	22	Malonylation
LYS	39	Malonylation
TYR	137	Phosphorylation			PyMOL_Chai1
SER	142	Phosphorylation			PyMOL_Chai1
LYS	18	Ubiquitination
LYS	39	Ubiquitination
LYS	148	Ubiquitination
LYS	179	Ubiquitination