PDB ligand accession: H1L
DrugBank: DB07870
InChI Key: GOCUAJYOYBLQRH-MRVPVSSYSA-N
SMILES: CC(C(=O)O)Oc1ccc(cc1)Oc2c(cc(cn2)C(F)(F)F)Cl
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: 2-phenoxypropionic acids
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name |
---|---|---|---|---|
O00763 | Download | Predicted | O00763_F1_nD6 O00763_F1_nD4 O00763_F1_nD3 O00763_F1_nD5 O00763_F1_nD10 O00763_F1_nD9 O00763_F1_nD1 O00763_F1_nD2 | Repetitive alpha hairpins Methylcrotonyl-CoA carboxylase alpha-subunit BT domain-related alpha/beta-Hammerhead/Barrel-sandwich hybrid alpha/beta-Hammerhead/Barrel-sandwich hybrid ClpP/crotonase ClpP/crotonase Rossmann-like Protein kinase/SAICAR synthase/ATP-grasp |
2DN8 | Predicted | e2dn8A1 | ||
2HJW | Predicted | e2hjwA1 e2hjwA3 e2hjwA2 | ||
2KCC | Predicted | e2kccA1 | ||
3FF6 | Predicted | e3ff6B2 e3ff6D1 e3ff6B1 e3ff6D2 e3ff6A1 e3ff6A2 e3ff6C1 e3ff6C2 | ||
3GID | Predicted | e3gidA2 e3gidB2 e3gidA3 e3gidB3 e3gidA4 e3gidB4 | ||
3GLK | Predicted | e3glkA3 e3glkA2 e3glkA1 | ||
3JRW | Predicted | e3jrwA1 e3jrwA3 e3jrwA2 | ||
3JRX | Predicted | e3jrxA1 e3jrxA3 e3jrxA2 | ||
3TDC | Predicted | e3tdcA1 e3tdcA2 | ||
4HQ6 | Predicted | e4hq6A1 e4hq6A3 e4hq6A2 | ||
5KKN | Predicted | e5kknB3 e5kknC3 e5kknB2 e5kknC2 e5kknB1 e5kknC1 |