Attributes
UniProt ID
Protein Name
biotin-- ligase
Ligand Name
N-({[(1R,3S)-3-(6-amino-9H-purin-9-yl)cyclopentyl]methyl}sulfamoyl)-5-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanamide
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
WZGWWAMUOOWNHU-MDLJMBGESA-N
SMILES
c1nc(c2c(n1)n(cn2)C3CCC(C3)CNS(=O)(=O)NC(=O)CCCCC4C5C(CS4)NC(=O)N5)N
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 4XTV
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Color Legend
Unassigned regionsLigand / hetero atomse4xtvA1e4xtvA2e4xtvB1e4xtvB2
ECOD domains from experimental PDB structures interacting with ligand 44K
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| A0A045H8W3 | n/a | 44K | 4xtv | e4xtvA1 | A:209-265 |
| A0A045H8W3 | n/a | 44K | 4xtv | e4xtvA2 | A:2-208 |
| A0A045H8W3 | n/a | 44K | 4xtv | e4xtvB1 | B:3-208 |
| A0A045H8W3 | n/a | 44K | 4xtv | e4xtvB2 | B:209-266 |