Receptor
PDB id Resolution Class Description Source Keywords
1I7E 1.95 Å NON-ENZYME: SIGNAL_HORMONE C-TERMINAL DOMAIN OF MOUSE BRAIN TUBBY PROTEIN BOUND TO PHOSPHATIDYLINOSITOL 4,5-BIS-PHOSPHATE MUS MUSCULUS TUBBY FILLED-BARREL BETA-BARREL FILLED-BETA-ROLL 12-STRANDEDBARREL HELIX-FILLED-BARREL OBESITY BLINDNESS DEAFNESS PHOSPHOINOSITIDE PHOSPHATIDYLINOSITOL SIGNALING PROTEIN
Ref.: G-PROTEIN SIGNALING THROUGH TUBBY PROTEINS. SCIENCE V. 292 2041 2001
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
IBS A:2001;
 Valid;
 none;
 submit data
492.158 C9 H19 O17 P3 C(C(=...
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90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1I7E 1.95 Å NON-ENZYME: SIGNAL_HORMONE C-TERMINAL DOMAIN OF MOUSE BRAIN TUBBY PROTEIN BOUND TO PHOSPHATIDYLINOSITOL 4,5-BIS-PHOSPHATE MUS MUSCULUS TUBBY FILLED-BARREL BETA-BARREL FILLED-BETA-ROLL 12-STRANDEDBARREL HELIX-FILLED-BARREL OBESITY BLINDNESS DEAFNESS PHOSPHOINOSITIDE PHOSPHATIDYLINOSITOL SIGNALING PROTEIN
Ref.: G-PROTEIN SIGNALING THROUGH TUBBY PROTEINS. SCIENCE V. 292 2041 2001
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 289 families.
1 1I7E - IBS C9 H19 O17 P3 C(C(=O)CO[....
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 1I7E - IBS C9 H19 O17 P3 C(C(=O)CO[....
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 1I7E - IBS C9 H19 O17 P3 C(C(=O)CO[....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: IBS; Similar ligands found: 8
No: Ligand ECFP6 Tc MDL keys Tc
1 IBS 1 1
2 I3S 0.511111 0.789474
3 I3P 0.511111 0.789474
4 PBU 0.450704 0.787234
5 I0P 0.413043 0.763158
6 PIO 0.405063 0.74
7 52N 0.405063 0.74
8 13P 0.404255 0.815789
Similar Ligands (3D)
Ligand no: 1; Ligand: IBS; 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 : 1I7E; Ligand: IBS; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 1) in the query (biounit: 1i7e.bio1) has 12 residues
No: Leader PDB Ligand Sequence Similarity
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