PDB ligand accession: HEM
DrugBank: DB18267
PubChem: n/a
ChEMBL: n/a
InChI Key: KABFMIBPWCXCRK-RGGAHWMASA-L
SMILES: Cc1c2n3c(c1CCC(=O)O)C=C4C(=C(C5=[N]4[Fe]36[N]7=C(C=C8N6C(=C5)C(=C8C)C=C)C(=C(C7=C2)C)C=C)C)CCC(=O)O
Drug action: n/a
| PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
|---|---|---|---|---|---|
| 4QOO | Download | Experimental | e4qooA2 e4qooA3 e4qooD1 e4qooB2 e4qooB3 e4qooC2 e4qooB2 e4qooC1 e4qooC2 e4qooA2 e4qooA3 e4qooD1 e4qooD3 | 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 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 | LigPlot |
| 4QOR | Download | Experimental | e4qorA1 e4qorA2 e4qorD1 e4qorB1 e4qorB3 e4qorC1 e4qorB3 e4qorC1 e4qorC3 e4qorA1 e4qorA2 e4qorD1 e4qorD3 | 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 Barrel domain in heme-dependent catalases First alpha-helical 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 | LigPlot |
| 4QOQ | Download | Experimental | e4qoqA2 e4qoqA3 e4qoqD2 e4qoqB1 e4qoqB3 e4qoqC2 e4qoqB1 e4qoqC2 e4qoqC3 e4qoqA2 e4qoqA3 e4qoqD2 e4qoqD3 | 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 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 | LigPlot |
| 4QOM | Download | Experimental | e4qomA1 e4qomA3 e4qomD2 e4qomB1 e4qomB2 e4qomC3 e4qomB2 e4qomC1 e4qomC3 e4qomA1 e4qomA3 e4qomD2 e4qomD3 | 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 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 | LigPlot |
| 4QOP | Download | Experimental | e4qopA1 e4qopA3 e4qopD1 e4qopB1 e4qopB2 e4qopC1 e4qopB2 e4qopC1 e4qopC3 e4qopA1 e4qopA3 e4qopD1 e4qopD3 | 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 Barrel domain in heme-dependent catalases First alpha-helical 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 | LigPlot |
| 4QON | Download | Experimental | e4qonA1 e4qonA2 e4qonD3 e4qonB2 e4qonB3 e4qonC2 e4qonB3 e4qonC2 e4qonC3 e4qonA1 e4qonA2 e4qonD1 e4qonD3 | 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 Barrel domain in heme-dependent catalases First alpha-helical 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 |
| 4QOL | Download | Experimental | e4qolA1 e4qolA3 e4qolD2 e4qolB1 e4qolB3 e4qolC2 e4qolB1 e4qolC1 e4qolC2 e4qolA1 e4qolA3 e4qolD2 e4qolD3 | 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 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 | LigPlot |