Attributes
UniProt ID
Protein Name
Putative crotonyl-CoA reductase
Ligand Name
5'-O-[(S)-{[(S)-[(3R)-4-({(1E)-3-[(2-{[(2S)-2-carboxybutanoyl]sulfanyl}ethyl)amino]-3-oxoprop-1-en-1-yl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutoxy](hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]adenosine 3'-(dihydrogen phosphate)
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
FBYIVOIRCUIQPJ-YWIQEZFGSA-N
SMILES
CCC(C(=O)O)C(=O)SCCNC(=O)C=CNC(=O)C(C(C)(C)COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)n2cnc3c2ncnc3N)O)OP(=O)(O)O)O
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
Interactive Mol* view for the current protein-molecule pair.
Structure: 6OWE
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Color Legend
Unassigned regionsLigand / hetero atomse6oweA1e6oweA2e6oweB1e6oweB2e6oweC1e6oweC2e6oweD1e6oweD2
ECOD domains from experimental PDB structures interacting with ligand N9V
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| E4N096 | n/a | N9V | 6owe | e6oweA1 | A:-1-233,A:405-444 |
| E4N096 | n/a | N9V | 6owe | e6oweA2 | A:227-277,A:297-404 |
| E4N096 | n/a | N9V | 6owe | e6oweB1 | B:-3-233,B:405-444 |
| E4N096 | n/a | N9V | 6owe | e6oweB2 | B:227-277,B:297-404 |
| E4N096 | n/a | N9V | 6owe | e6oweC1 | C:227-277,C:297-404 |
| E4N096 | n/a | N9V | 6owe | e6oweD2 | D:227-277,D:297-404 |