PDB ligand accession: 1HA
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: ZHSLHXZSNOSMQG-HSJNEKGZSA-N
SMILES: CC(C)(COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)n2cnc3c2ncnc3N)O)OP(=O)(O)O)C(C(=O)NCCC(=O)NCCSC(=O)c4ccc5ccccc5c4O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Lipids and lipid-like molecules
- Class: Fatty Acyls
- Subclass: Fatty acyl thioesters
- Class: Fatty Acyls
- Superclass: Lipids and lipid-like molecules
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4I42 | Download | Experimental | e4i42F1 e4i42A1 e4i42B1 e4i42F1 e4i42D1 e4i42E1 e4i42C1 e4i42A1 e4i42B1 e4i42E1 e4i42C1 e4i42E1 e4i42F1 e4i42A1 e4i42G1 e4i42L1 e4i42J1 e4i42L1 e4i42H1 e4i42J1 e4i42K1 e4i42G1 e4i42I1 e4i42H1 e4i42I1 e4i42J1 e4i42K1 e4i42I1 e4i42K1 e4i42G1 e4i42L1 | ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase ClpP/crotonase | LigPlot |