Receptor
PDB id Resolution Class Description Source Keywords
4NXR 1.9 Å NON-ENZYME: OTHER CRYSTAL STRUCTURE OF T-CELL LYMPHOMA INVASION AND METASTASIS DOMAIN QUADRUPLE MUTANT (QM) IN COMPLEX WITH NEUREXIN-1 PEP HOMO SAPIENS BETA BARREL FOLD PROTEIN PDZ DOMAIN PEPTIDE BINDING SPECIMUTANT SCAFFOLD SIGNALING PROTEIN FOR CELL ADHESION AND CEJUNCTION SIGNALING DOMAIN SIGNALING PROTEIN-PEPTIDE COMPL
Ref.: DISTINCT ROLES FOR CONFORMATIONAL DYNAMICS IN PROTE INTERACTIONS. STRUCTURE V. 24 2053 2016
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
EPE A:1001;
 Invalid;
 none;
 submit data
238.305 C8 H18 N2 O4 S C1CN(...
ASN LYS ASP LYS GLU TYR TYR VAL ANS B:1;
 Valid;
 none;
 Kd = 46 uM
1292.46 n/a S(=O)...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
4NXQ 2.1 Å NON-ENZYME: OTHER CRYSTAL STRUCTURE OF T-CELL LYMPHOMA INVASION AND METASTASIS DOMAIN QUADRUPLE MUTANT (QM) IN COMPLEX WITH CASPR4 PEPTIDE HOMO SAPIENS BETA BARREL FOLD PROTEIN PDZ DOMAIN; PEPTIDE BINDING SPECIMUTANT SCAFFOLD SIGNALING PROTEIN FOR CELL ADHESION AND CEJUNCTION SIGNALING DOMAIN PROTEIN-PEPTIDE COMPLEX SIGNALPROTEIN-PEPTIDE COMPLEX
Ref.: DISTINCT ROLES FOR CONFORMATIONAL DYNAMICS IN PROTE INTERACTIONS. STRUCTURE V. 24 2053 2016
Members (3)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1610 families.
1 4NXQ Kd = 18 uM GLU ASN GLN LYS GLU TYR PHE PHE n/a n/a
2 3KZE - SER SER ARG LYS GLU TYR TYR ALA n/a n/a
3 4NXR Kd = 46 uM ASN LYS ASP LYS GLU TYR TYR VAL ANS n/a n/a
70% Homology Family (3)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1331 families.
1 4NXQ Kd = 18 uM GLU ASN GLN LYS GLU TYR PHE PHE n/a n/a
2 3KZE - SER SER ARG LYS GLU TYR TYR ALA n/a n/a
3 4NXR Kd = 46 uM ASN LYS ASP LYS GLU TYR TYR VAL ANS n/a n/a
50% Homology Family (3)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1144 families.
1 4NXQ Kd = 18 uM GLU ASN GLN LYS GLU TYR PHE PHE n/a n/a
2 3KZE - SER SER ARG LYS GLU TYR TYR ALA n/a n/a
3 4NXR Kd = 46 uM ASN LYS ASP LYS GLU TYR TYR VAL ANS n/a n/a
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: ASN LYS ASP LYS GLU TYR TYR VAL ANS; Similar ligands found: 11
Similar Ligands (3D)
Ligand no: 1; Ligand: ASN LYS ASP LYS GLU TYR TYR VAL ANS; 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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