PDB ligand accession: TIO
DrugBank: DB08626
InChI Key: LJJKNPQAGWVLDQ-SNVBAGLBSA-N
SMILES: c1ccc(cc1)CC(CS)C(=O)NCC(=O)O
Drug action: inhibitor
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic acids and derivatives
- Class: Carboxylic acids and derivatives
- Subclass: Amino acids, peptides, and analogues
- Class: Carboxylic acids and derivatives
- Superclass: Organic acids and derivatives
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name |
---|---|---|---|---|
P08473 | Download | Predicted | P08473_F1_nD1 | Zincin-like |
1DMT | Predicted | e1dmtA1 | ||
1R1H | Predicted | e1r1hA1 | ||
1R1I | Predicted | e1r1iA1 | ||
1R1J | Predicted | e1r1jA1 | ||
1Y8J | Predicted | e1y8jA1 | ||
2QPJ | Predicted | e2qpjA1 | ||
2YB9 | Predicted | e2yb9A1 | ||
4CTH | Predicted | e4cthA1 | ||
5JMY | Predicted | e5jmyA1 e5jmyB1 | ||
6GID | Predicted | e6gidA1 | ||
6SH1 | Predicted | e6sh1AAA1 e6sh1CCC1 | ||
6SH2 | Predicted | e6sh2AAA1 |