Receptor
PDB id Resolution Class Description Source Keywords
2QT5 2.3 Å NON-ENZYME: SIGNAL_HORMONE CRYSTAL STRUCTURE OF GRIP1 PDZ12 IN COMPLEX WITH THE FRAS1 PEPTIDE RATTUS NORVEGICUS PDZ-PEPTIDE COMPLEX PDZ TANDEM ALTERNATIVE SPLICING CELL JUNCTION CYTOPLASM ENDOPLASMIC RETICULUM MEMBRANE POSTSYNAPTIC CELL MEMBRANE SYNAPSE PROTEIN BINDING PEPTIDE BINDING PROTEIN
Ref.: SUPRAMODULAR NATURE OF GRIP1 REVEALED BY THE STRUCTURE OF ITS PDZ12 TANDEM IN COMPLEX WITH THE CARBOXYL TAIL OF FRAS1. J.MOL.BIOL. V. 375 1457 2008
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
ACY A:2;
A:244;
 Invalid;
Invalid;
 none;
none;
 submit data
60.052 C2 H4 O2 CC(=O...
ASN ASN LEU GLN ASP GLY THR GLU VAL X:1006;
Y:2006;
 Valid;
Valid;
 none;
none;
 Kd ~ 9.4 uM
402.404 n/a O=C([...
EDO A:1;
B:2;
 Invalid;
Invalid;
 none;
none;
 submit data
62.068 C2 H6 O2 C(CO)...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
2QT5 2.3 Å NON-ENZYME: SIGNAL_HORMONE CRYSTAL STRUCTURE OF GRIP1 PDZ12 IN COMPLEX WITH THE FRAS1 PEPTIDE RATTUS NORVEGICUS PDZ-PEPTIDE COMPLEX PDZ TANDEM ALTERNATIVE SPLICING CELL JUNCTION CYTOPLASM ENDOPLASMIC RETICULUM MEMBRANE POSTSYNAPTIC CELL MEMBRANE SYNAPSE PROTEIN BINDING PEPTIDE BINDING PROTEIN
Ref.: SUPRAMODULAR NATURE OF GRIP1 REVEALED BY THE STRUCTURE OF ITS PDZ12 TANDEM IN COMPLEX WITH THE CARBOXYL TAIL OF FRAS1. J.MOL.BIOL. V. 375 1457 2008
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 289 families.
1 2QT5 Kd ~ 9.4 uM ASN ASN LEU GLN ASP GLY THR GLU VAL n/a n/a
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 2QT5 Kd ~ 9.4 uM ASN ASN LEU GLN ASP GLY THR GLU VAL n/a n/a
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 2QT5 Kd ~ 9.4 uM ASN ASN LEU GLN ASP GLY THR GLU VAL n/a n/a
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: ASN ASN LEU GLN ASP GLY THR GLU VAL; Similar ligands found: 24
No: Ligand ECFP6 Tc MDL keys Tc
1 ASN ASN LEU GLN ASP GLY THR GLU VAL 1 1
2 ARG ARG ARG GLU THR GLN VAL 0.53012 0.823529
3 LYS GLN THR SER VAL 0.527778 0.931818
4 ACE ILE GLU SER THR GLU ILE 0.493671 0.829787
5 ARG GLU ASP GLN GLU THR ALA VAL 0.471264 0.886364
6 ALA ILE GLU THR ASA 0.468354 0.844444
7 ARG LEU GLN ARG ARG ARG GLU THR GLN VAL 0.463158 0.807692
8 ALA GLU THR PHE 0.45 0.844444
9 ACE THR GLU ASP VAL VAL CYS CYS 0.447059 0.909091
10 ACE VAL GLU ILE ASA 0.443038 0.772727
11 ACE ASP GLU VAL ASP 0QE 0.441558 0.782609
12 ACE VAL LYS GLU SER LEU VAL 0.436782 0.891304
13 PRO THR VAL GLU GLU VAL ASP 0.431818 0.823529
14 GLU VAL 0.42623 0.785714
15 ASP GLU THR ASN LEU 0.425287 0.847826
16 THR ASN GLU TYR TYR VAL 0.423529 0.745098
17 GLU GLU ILE ASP VAL VAL SER VAL 0.422222 0.851064
18 ACE ASP GLU VAL ASP ASP GLU VAL ASP 0.415584 0.755556
19 THR LEU ILE ASP LEU THR GLU LEU ILE 0.413043 0.866667
20 PRO THR SER SER GLU GLN ILE 0.410526 0.759259
21 ALA SER ASN GLU ASN MET GLU THR MET 0.406593 0.769231
22 THR ARG ARG GLU THR GLN LEU 0.404255 0.807692
23 VAL THR THR ASP ILE GLN VAL LYS VAL 0.40404 0.893617
24 SAC ARG GLY THR GLN THR GLU 0.4 0.773585
Similar Ligands (3D)
Ligand no: 1; Ligand: ASN ASN LEU GLN ASP GLY THR GLU VAL; Similar ligands found: 0
No: Ligand Similarity coefficient
Similar Binding Sites (Proteins are less than 50% similar to leader) APoc FAQ
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