PDB ligand accession: VLB
DrugBank: DB00570
InChI Key: JXLYSJRDGCGARV-CFWMRBGOSA-N
SMILES: CCC1(CC2CC(c3c(c4ccccc4[nH]3)CCN(C2)C1)(c5cc6c(cc5OC)N(C7C68CCN9C8C(C=CC9)(C(C7(C(=O)OC)O)OC(=O)C)CC)C)C(=O)OC)O
Drug action: binder
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Alkaloids and derivatives
- Class: Vinca alkaloids
- Subclass: None
- Class: Vinca alkaloids
- Superclass: Alkaloids and derivatives
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name |
---|---|---|---|---|
P23258 | Download | Predicted | P23258_F1_nD2 P23258_F1_nD1 | Bacillus chorismate mutase-like Rossmann-like |
1Z5V | Predicted | e1z5vA2 e1z5vA1 | ||
1Z5W | Predicted | e1z5wA2 e1z5wA1 | ||
3CB2 | Predicted | e3cb2A1 e3cb2B4 e3cb2A2 e3cb2B3 | ||
6V5V | Predicted | e6v5vg1 e6v5vg2 | ||
6V6S | Predicted | e6v6sa2 e6v6sb2 e6v6sc1 e6v6sd1 e6v6se1 e6v6sf1 e6v6sg1 e6v6sh2 e6v6si2 e6v6sj1 e6v6sk1 e6v6sl1 e6v6sm2 e6v6st2 e6v6sa1 e6v6sb1 e6v6sc2 e6v6sd2 e6v6se2 e6v6sf2 e6v6sg2 e6v6sh1 e6v6si1 e6v6sj2 e6v6sk2 e6v6sl2 e6v6sm1 e6v6st1 |