PDB ligand accession: SAH
DrugBank: DB01752
PubChem: 439155;25246222;
ChEMBL:
InChI Key: ZJUKTBDSGOFHSH-WFMPWKQPSA-N
SMILES: c1nc(c2c(n1)n(cn2)C3C(C(C(O3)CSCCC(C(=O)O)N)O)O)N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Nucleosides, nucleotides, and analogues
- Class: 5'-deoxyribonucleosides
- Subclass: 5'-deoxy-5'-thionucleosides
- Class: 5'-deoxyribonucleosides
- Superclass: Nucleosides, nucleotides, and analogues
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
2V7T | Download | Experimental | e2v7tC2 e2v7tA1 e2v7tA2 e2v7tB1 e2v7tA1 e2v7tB2 e2v7tC1 | Bacterial fluorinating enzyme, N-terminal domain cradle loop barrel Bacterial fluorinating enzyme, N-terminal domain cradle loop barrel cradle loop barrel Bacterial fluorinating enzyme, N-terminal domain cradle loop barrel | LigPlot |