Attributes
UniProt ID
Protein Name
Uptake hydrogenase large subunit
Ligand Name
NI-FE OXIDIZED ACTIVE CENTER
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
MPQMGFDSXFFIQL-UHFFFAOYSA-N
SMILES
C(#N)[Fe](C#N)(C#O)O[Ni]
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 3MYR
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Color Legend
Unassigned regionsLigand / hetero atomse3myrA1e3myrA2e3myrB1e3myrB2e3myrB3e3myrB4e3myrC1e3myrC2e3myrD1e3myrD2e3myrD3e3myrD4e3myrE1e3myrE2e3myrF1e3myrF2e3myrF3e3myrF4e3myrG1e3myrG2e3myrH1e3myrH2e3myrH3e3myrH4
ECOD domains from experimental PDB structures interacting with ligand NFV
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| D3RV26 | n/a | NFV | 3myr | e3myrB1 | B:1081-1319,B:1384-1473 |
| D3RV26 | n/a | NFV | 3myr | e3myrB2 | B:1038-1080,B:1474-1519 |
| D3RV26 | n/a | NFV | 3myr | e3myrB3 | B:1003-1037,B:1520-1561 |
| D3RV26 | n/a | NFV | 3myr | e3myrD2 | D:1081-1319,D:1384-1473 |
| D3RV26 | n/a | NFV | 3myr | e3myrD3 | D:1001-1037,D:1520-1561 |
| D3RV26 | n/a | NFV | 3myr | e3myrD4 | D:1038-1080,D:1474-1519 |
| D3RV26 | n/a | NFV | 3myr | e3myrF2 | F:1081-1319,F:1384-1473 |
| D3RV26 | n/a | NFV | 3myr | e3myrF3 | F:1001-1037,F:1520-1561 |
| D3RV26 | n/a | NFV | 3myr | e3myrF4 | F:1038-1080,F:1474-1519 |
| D3RV26 | n/a | NFV | 3myr | e3myrH2 | H:1081-1319,H:1384-1473 |
| D3RV26 | n/a | NFV | 3myr | e3myrH3 | H:1003-1037,H:1520-1561 |
| D3RV26 | n/a | NFV | 3myr | e3myrH4 | H:1038-1080,H:1474-1519 |