Attributes
UniProt ID
Protein Name
Iron hydrogenase 1
Ligand Name
dicarbonyl[bis(cyanide-kappaC)]-mu-(iminodimethanethiolatato-1kappaS:2kappaS)-mu-(oxomethylidene)diiron(2+)
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
LJPDYWPSPOWMIB-UHFFFAOYSA-N
SMILES
C1NC[S]2[Fe]3([S]1[Fe]2(C3=O)(C#N)C#[O+])(C#N)C#[O+]
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 4XDC
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Color Legend
Unassigned regionsLigand / hetero atomse4xdcA1e4xdcA2e4xdcA3e4xdcA4e4xdcA5e4xdcB1e4xdcB2e4xdcB3e4xdcB4e4xdcB5
ECOD domains from experimental PDB structures interacting with ligand 402
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| P29166 | n/a | 402 | 4xdc | e4xdcA5 | A:210-511 |
| P29166 | n/a | 402 | 4xdc | e4xdcB5 | B:210-511 |
| P29166 | n/a | 402 | 5la3 | e5la3A4 | A:210-511 |
| P29166 | n/a | 402 | 5la3 | e5la3B3 | B:210-511 |
| P29166 | n/a | 402 | 6gly | e6glyA2 | A:210-511 |
| P29166 | n/a | 402 | 6gly | e6glyB4 | B:210-511 |
| P29166 | n/a | 402 | 6glz | e6glzA1 | A:210-511 |
| P29166 | n/a | 402 | 6glz | e6glzB2 | B:210-511 |
| P29166 | n/a | 402 | 6gm0 | e6gm0A5 | A:210-511 |
| P29166 | n/a | 402 | 6gm0 | e6gm0B5 | B:210-511 |
| P29166 | n/a | 402 | 6gm1 | e6gm1A2 | A:210-511 |
| P29166 | n/a | 402 | 6gm1 | e6gm1B1 | B:210-511 |
| P29166 | n/a | 402 | 6gm2 | e6gm2A4 | A:210-511 |
| P29166 | n/a | 402 | 6gm2 | e6gm2B3 | B:210-511 |
| P29166 | n/a | 402 | 6gm3 | e6gm3A5 | A:210-511 |
| P29166 | n/a | 402 | 6gm3 | e6gm3B1 | B:210-511 |
| P29166 | n/a | 402 | 6gm4 | e6gm4A3 | A:210-511 |
| P29166 | n/a | 402 | 6gm4 | e6gm4B3 | B:210-511 |
| P29166 | n/a | 402 | 6gm8 | e6gm8A5 | A:210-511 |
| P29166 | n/a | 402 | 6gm8 | e6gm8B5 | B:210-511 |
| P29166 | n/a | 402 | 6n59 | e6n59A2 | A:210-511 |
| P29166 | n/a | 402 | 6n6p | e6n6pA5 | A:210-511 |
| P29166 | n/a | 402 | 6nac | e6nacA3 | A:210-511 |
| P29166 | n/a | 402 | 6yf4 | e6yf4A2 | A:210-511 |
| P29166 | n/a | 402 | 6yf4 | e6yf4B2 | B:210-511 |
| P29166 | n/a | 402 | 7qhf | e7qhfA4 | A:210-511 |
| P29166 | n/a | 402 | 7qhf | e7qhfB4 | B:210-511 |
| P29166 | n/a | 402 | 8cjy | e8cjyA3 | A:210-511 |
| P29166 | n/a | 402 | 8cjy | e8cjyB1 | B:210-511 |