PDB ligand accession: HDE
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: SQSYUADQFVTXKU-CAMYIWQSSA-N
SMILES: CCc1c(c2n3c1Cc4c(c(c5n4[Fe]36n7c(c(c(c7C=C8N6C(=C5)C9(C8(C)O)CCC(=O)O9)C)CC)C2)CCC(=O)O)C)C
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Tetrapyrroles and derivatives
- Subclass: Metallotetrapyrroles
- Class: Tetrapyrroles and derivatives
- Superclass: Organoheterocyclic compounds
| PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
|---|---|---|---|---|---|
| 3PQ8 | Download | Experimental | e3pq8A5 e3pq8A6 e3pq8D6 e3pq8C6 e3pq8B5 e3pq8B6 e3pq8C5 e3pq8C6 e3pq8B6 e3pq8A5 e3pq8A6 e3pq8D5 e3pq8D6 | First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases Barrel domain in heme-dependent catalases Barrel domain in heme-dependent catalases First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases Barrel domain in heme-dependent catalases First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases | LigPlot |
| 3P9S | Download | Experimental | e3p9sA5 e3p9sA6 e3p9sD6 e3p9sB5 e3p9sB6 e3p9sC6 e3p9sB6 e3p9sC5 e3p9sC6 e3p9sA5 e3p9sA6 e3p9sD5 e3p9sD6 | First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases Barrel domain in heme-dependent catalases First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases Barrel domain in heme-dependent catalases Barrel domain in heme-dependent catalases First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases | LigPlot |
| 3P9P | Download | Experimental | e3p9pA5 e3p9pA6 e3p9pD6 e3p9pB5 e3p9pB6 e3p9pC6 e3p9pB6 e3p9pC5 e3p9pC6 e3p9pA5 e3p9pA6 e3p9pD5 e3p9pD6 | First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases Barrel domain in heme-dependent catalases First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases Barrel domain in heme-dependent catalases Barrel domain in heme-dependent catalases First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases | LigPlot |
| 3PQ2 | Download | Experimental | e3pq2A5 e3pq2A6 e3pq2D6 e3pq2B5 e3pq2B6 e3pq2C6 e3pq2B6 e3pq2C5 e3pq2C6 e3pq2A5 e3pq2A6 e3pq2D5 e3pq2D6 | First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases Barrel domain in heme-dependent catalases First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases Barrel domain in heme-dependent catalases Barrel domain in heme-dependent catalases First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases | LigPlot |
| 3PQ4 | Download | Experimental | e3pq4A5 e3pq4A6 e3pq4D6 e3pq4B5 e3pq4B6 e3pq4C6 e3pq4B6 e3pq4C5 e3pq4C6 e3pq4A5 e3pq4A6 e3pq4D5 e3pq4D6 | First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases Barrel domain in heme-dependent catalases First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases Barrel domain in heme-dependent catalases Barrel domain in heme-dependent catalases First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases | LigPlot |
| 3PQ6 | Download | Experimental | e3pq6A5 e3pq6A6 e3pq6D6 e3pq6B5 e3pq6B6 e3pq6C6 e3pq6B6 e3pq6C5 e3pq6C6 e3pq6A5 e3pq6A6 e3pq6D5 e3pq6D6 | First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases Barrel domain in heme-dependent catalases First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases Barrel domain in heme-dependent catalases Barrel domain in heme-dependent catalases First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases | LigPlot |
| 3P9Q | Download | Experimental | e3p9qA5 e3p9qA6 e3p9qD6 e3p9qB5 e3p9qB6 e3p9qC6 e3p9qB6 e3p9qC5 e3p9qC6 e3p9qA5 e3p9qA6 e3p9qD5 e3p9qD6 | First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases Barrel domain in heme-dependent catalases First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases Barrel domain in heme-dependent catalases Barrel domain in heme-dependent catalases First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases | LigPlot |
| 3PQ3 | Download | Experimental | e3pq3A5 e3pq3A6 e3pq3D6 e3pq3B5 e3pq3B6 e3pq3C6 e3pq3B6 e3pq3C5 e3pq3C6 e3pq3A5 e3pq3A6 e3pq3D5 e3pq3D6 | First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases Barrel domain in heme-dependent catalases First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases Barrel domain in heme-dependent catalases Barrel domain in heme-dependent catalases First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases | LigPlot |
| 3PQ7 | Download | Experimental | e3pq7A5 e3pq7A6 e3pq7D6 e3pq7B5 e3pq7B6 e3pq7C6 e3pq7B6 e3pq7C5 e3pq7C6 e3pq7A5 e3pq7A6 e3pq7D5 e3pq7D6 | First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases Barrel domain in heme-dependent catalases First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases Barrel domain in heme-dependent catalases Barrel domain in heme-dependent catalases First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases | LigPlot |
| 3PQ5 | Download | Experimental | e3pq5A5 e3pq5A6 e3pq5D6 e3pq5B5 e3pq5B6 e3pq5C6 e3pq5B6 e3pq5C5 e3pq5C6 e3pq5A5 e3pq5A6 e3pq5D5 e3pq5D6 | First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases Barrel domain in heme-dependent catalases First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases Barrel domain in heme-dependent catalases Barrel domain in heme-dependent catalases First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases First alpha-helical domain in heme-dependent catalases Barrel domain in heme-dependent catalases | LigPlot |