Attributes
UniProt ID
Protein Name
n/a
Ligand Name
2-[(1R)-1-{[(E)-azepan-1-ylmethylidene]amino}-2-oxoethyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
GIESTXBEHWEDNC-XRSRENSCSA-N
SMILES
CC1(C(NC(S1)C(C=O)N=CN2CCCCCC2)C(=O)O)C
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
Interactive Mol* view for the current protein-molecule pair.
Structure: 6TIX
Hover over the Mol* viewer to rotate or zoom with the mouse. Move the cursor out of the viewer to go back to normal page scrolling and one-click navigation.
Hover inside the viewer to rotate or zoom. Move out to scroll the page or click links normally.
Color Legend
Unassigned regionsLigand / hetero atomse6tixAAA1e6tixAAA2e6tixAAA3e6tixAAA4e6tixBBB1e6tixBBB2e6tixBBB3e6tixBBB4
ECOD domains from experimental PDB structures interacting with ligand DH4
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| A0A384KFW3 | n/a | DH4 | 6tix | e6tixAAA2 | AAA:328-459 |
| A0A384KFW3 | n/a | DH4 | 6tix | e6tixAAA4 | AAA:255-327,AAA:460-613 |
| A0A384KFW3 | n/a | DH4 | 6tix | e6tixBBB2 | BBB:255-327,BBB:460-611 |
| A0A384KFW3 | n/a | DH4 | 6tix | e6tixBBB4 | BBB:328-459 |