PDB ligand accession: CNC
DrugBank: DB00115
PubChem: n/a
ChEMBL: n/a
InChI Key: SYZBZQWSWIJYAR-UVKKECPRSA-M
SMILES: Cc1cc2c(cc1C)n(cn2)C3C(C(C(O3)CO)OP(=O)(O)OC(C)CNC(=O)CCC4(C(C5C6(C(C(C7=[N]6[Co+2]89(N5C4=C(C1=[N]8C(=CC2=[N]9C(=C7C)C(C2CCC(=O)N)(C)CC(=O)N)C(C1CCC(=O)N)(C)C)C)C#N)CCC(=O)N)(C)CC(=O)N)C)CC(=O)N)C)O
Drug action: n/a
| PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
|---|---|---|---|---|---|
| 1UC5 | Download | Experimental | e1uc5B1 e1uc5A1 e1uc5E1 e1uc5L1 | B12-dependent dehydratase associated subunit TIM beta/alpha-barrel B12-dependent dehydratase associated subunit TIM beta/alpha-barrel | LigPlot |
| 1EGM | Download | Experimental | e1egmB1 e1egmA1 e1egmE1 e1egmL1 | B12-dependent dehydratase associated subunit TIM beta/alpha-barrel B12-dependent dehydratase associated subunit TIM beta/alpha-barrel | LigPlot |
| 1UC4 | Download | Experimental | e1uc4B1 e1uc4A1 e1uc4E1 e1uc4L1 | B12-dependent dehydratase associated subunit TIM beta/alpha-barrel B12-dependent dehydratase associated subunit TIM beta/alpha-barrel | LigPlot |