Receptor
PDB id Resolution Class Description Source Keywords
3SP6 2.21 Å NON-ENZYME: SIGNAL_HORMONE STRUCTURAL BASIS FOR ILOPROST AS A DUAL PPARALPHA/DELTA AGON HOMO SAPIENS PPAR LBD NUCLEAR RECEPTOR FOLD LIGAND BINDING GENE TRANSCTRANSCRIPTION
Ref.: STRUCTURAL BASIS FOR ILOPROST AS A DUAL PEROXISOME PROLIFERATOR-ACTIVATED RECEPTOR ALPHA/DELTA AGONIST J.BIOL.CHEM. V. 286 31473 2011
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
IL2 A:901;
Valid;
none;
submit data
360.487 C22 H32 O4 CC#CC...
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90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
3SP6 2.21 Å NON-ENZYME: SIGNAL_HORMONE STRUCTURAL BASIS FOR ILOPROST AS A DUAL PPARALPHA/DELTA AGON HOMO SAPIENS PPAR LBD NUCLEAR RECEPTOR FOLD LIGAND BINDING GENE TRANSCTRANSCRIPTION
Ref.: STRUCTURAL BASIS FOR ILOPROST AS A DUAL PEROXISOME PROLIFERATOR-ACTIVATED RECEPTOR ALPHA/DELTA AGONIST J.BIOL.CHEM. V. 286 31473 2011
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 289 families.
1 3SP6 - IL2 C22 H32 O4 CC#CC[C@@H....
70% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 214 families.
1 3SP6 - IL2 C22 H32 O4 CC#CC[C@@H....
50% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 181 families.
1 3SP6 - IL2 C22 H32 O4 CC#CC[C@@H....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: IL2; Similar ligands found: 1
No: Ligand ECFP6 Tc MDL keys Tc
1 IL2 1 1
Similar Ligands (3D)
Ligand no: 1; Ligand: IL2; Similar ligands found: 0
No: Ligand Similarity coefficient
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 3SP6; Ligand: IL2; Similar sites found with APoc: 6
This union binding pocket(no: 1) in the query (biounit: 3sp6.bio1) has 21 residues
No: Leader PDB Ligand Sequence Similarity
1 6ONJ BRL None
2 1NU4 MLA 8.24742
3 1NU4 MLA 8.24742
4 1NU4 MLA 8.24742
5 6LM1 OCT 15.0579
6 6LM1 D10 15.0579
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