Attributes
UniProt ID
Protein Name
3-hydroxydecanoyl- dehydratase
Ligand Name
(5-thiophen-2-ylisoxazol-3-yl)methanol
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
HUAGDHXVPCSWLD-UHFFFAOYSA-N
SMILES
c1cc(sc1)c2cc(no2)CO
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 4B0J
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Color Legend
Unassigned regionsLigand / hetero atomse4b0jA1e4b0jB1e4b0jC1e4b0jD1e4b0jE1e4b0jF1e4b0jG1e4b0jH1e4b0jI1e4b0jJ1e4b0jK1e4b0jL1e4b0jM1e4b0jN1e4b0jO1e4b0jP1e4b0jQ1e4b0jR1e4b0jS1e4b0jT1
ECOD domains from experimental PDB structures interacting with ligand 3MQ
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| O33877 | n/a | 3MQ | 4b0j | e4b0jA1 | A:1-166 |
| O33877 | n/a | 3MQ | 4b0j | e4b0jB1 | B:1-169 |
| O33877 | n/a | 3MQ | 4b0j | e4b0jC1 | C:1-167 |
| O33877 | n/a | 3MQ | 4b0j | e4b0jD1 | D:1-169 |
| O33877 | n/a | 3MQ | 4b0j | e4b0jE1 | E:1-167 |
| O33877 | n/a | 3MQ | 4b0j | e4b0jF1 | F:1-168 |
| O33877 | n/a | 3MQ | 4b0j | e4b0jG1 | G:1-165 |
| O33877 | n/a | 3MQ | 4b0j | e4b0jH1 | H:1-166 |
| O33877 | n/a | 3MQ | 4b0j | e4b0jI1 | I:1-168 |
| O33877 | n/a | 3MQ | 4b0j | e4b0jJ1 | J:1-167 |
| O33877 | n/a | 3MQ | 4b0j | e4b0jK1 | K:1-168 |
| O33877 | n/a | 3MQ | 4b0j | e4b0jL1 | L:1-169 |
| O33877 | n/a | 3MQ | 4b0j | e4b0jM1 | M:1-167 |
| O33877 | n/a | 3MQ | 4b0j | e4b0jN1 | N:1-167 |
| O33877 | n/a | 3MQ | 4b0j | e4b0jO1 | O:1-169 |
| O33877 | n/a | 3MQ | 4b0j | e4b0jP1 | P:1-169 |
| O33877 | n/a | 3MQ | 4b0j | e4b0jQ1 | Q:1-167 |
| O33877 | n/a | 3MQ | 4b0j | e4b0jR1 | R:1-166 |
| O33877 | n/a | 3MQ | 4b0j | e4b0jS1 | S:1-166 |
| O33877 | n/a | 3MQ | 4b0j | e4b0jT1 | T:1-166 |