Ligand name: (3Z,6S)-6-Chloro-1-(2-{[(5-chloro-1-benzothiophen-3-yl)methyl]amino}ethyl)-3-({2-[(2R)-2-piperidinyl]ethyl}imino)-2-piperazinol
PDB ligand accession: C2D
DrugBank: DB07521
PubChem: 131704305
ChEMBL: n/a
InChI Key: YHTGPUXGIBWHPN-IKQMYLSPSA-N
SMILES: [H][C@]1(CC\N=C2/NC[C@]([H])(Cl)N(CCNCC3=CSC4=CC=C(Cl)C=C34)C2O)CCCCN1
Drug action: n/a

List of small molecule binding-associated PTMs for P00734

Residue	UniProt number	Type of PTM	AlphaFold3 models	Rosetta models	Chai-1 models
LYS	599	Acetylation
SER	539	Phosphorylation
THR	540	Phosphorylation