Attributes
UniProt ID
Protein Name
E3 ubiquitin-protein ligase RNF31
Ligand Name
2-[3-[2,6-bis(fluoranyl)-4-(1~{H}-pyrazol-4-yl)phenyl]-3-oxidanylidene-propyl]-4-(1-methylpyrazol-4-yl)benzoic acid
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
NNCTWMTXMLKLDE-UHFFFAOYSA-N
SMILES
Cn1cc(cn1)c2ccc(c(c2)CCC(=O)c3c(cc(cc3F)c4c[nH]nc4)F)C(=O)O
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 6KC6
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Color Legend
Unassigned regionsLigand / hetero atomse6kc6A1e6kc6A2e6kc6C1e6kc6C2e6kc6E1e6kc6E2e6kc6G1e6kc6G2e6kc6I1e6kc6I2e6kc6K1e6kc6K2
ECOD domains from experimental PDB structures interacting with ligand D60
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| Q96EP0 | n/a | D60 | 6kc6 | e6kc6A1 | A:936-1070 |
| Q96EP0 | n/a | D60 | 6kc6 | e6kc6A2 | A:867-935 |
| Q96EP0 | n/a | D60 | 6kc6 | e6kc6C1 | C:867-935 |
| Q96EP0 | n/a | D60 | 6kc6 | e6kc6C2 | C:936-1070 |
| Q96EP0 | n/a | D60 | 6kc6 | e6kc6E1 | E:867-935 |
| Q96EP0 | n/a | D60 | 6kc6 | e6kc6E2 | E:936-1070 |
| Q96EP0 | n/a | D60 | 6kc6 | e6kc6G1 | G:868-935 |
| Q96EP0 | n/a | D60 | 6kc6 | e6kc6G2 | G:936-1070 |
| Q96EP0 | n/a | D60 | 6kc6 | e6kc6I1 | I:936-1070 |
| Q96EP0 | n/a | D60 | 6kc6 | e6kc6I2 | I:867-935 |
| Q96EP0 | n/a | D60 | 6kc6 | e6kc6K1 | K:936-1070 |
| Q96EP0 | n/a | D60 | 6kc6 | e6kc6K2 | K:867-935 |