PDB ligand accession: F43
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: XLFIRMYGVLUNOY-SXMZNAGASA-M
SMILES: CC12CC(=O)NC13CC4C(C(C5=[N]4[Ni+]67[N]3=C(C2CCC(=O)O)C=C8N6C(=C9C(=O)CCC1C9=[N]7C(C5)C1CC(=O)O)C(C8CC(=O)O)CCC(=O)O)(C)CC(=O)N)CCC(=O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Tetrapyrroles and derivatives
- Subclass: None
- Class: Tetrapyrroles and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5A8R | Download | Experimental | e5a8rA1 e5a8rD1 e5a8rE2 e5a8rF1 e5a8rA1 e5a8rA2 e5a8rD2 e5a8rB1 e5a8rC1 e5a8rG1 e5a8rG2 e5a8rJ1 e5a8rH2 e5a8rI1 e5a8rG1 e5a8rJ2 e5a8rK1 e5a8rL1 | Alpha-beta plaits Methyl-coenzyme M reductase alpha and beta chain-C Methyl-coenzyme M reductase alpha and beta chain-C Alpha-beta plaits Alpha-beta plaits Methyl-coenzyme M reductase alpha and beta chain-C Alpha-beta plaits Methyl-coenzyme M reductase alpha and beta chain-C Alpha-beta plaits Alpha-beta plaits Methyl-coenzyme M reductase alpha and beta chain-C Alpha-beta plaits Methyl-coenzyme M reductase alpha and beta chain-C Alpha-beta plaits Alpha-beta plaits Methyl-coenzyme M reductase alpha and beta chain-C Methyl-coenzyme M reductase alpha and beta chain-C Alpha-beta plaits | LigPlot |