Receptor
PDB id Resolution Class Description Source Keywords
1EXF 2.1 Å EC: 3.4.21.- EXFOLIATIVE TOXIN A STAPHYLOCOCCUS AUREUS COMPLEX (TOXIN/PEPTIDE) HYDROLASE SERINE PROTEASE SUPERANTIGEN
Ref.: THE STRUCTURE OF THE SUPERANTIGEN EXFOLIATIVE TOXIN A SUGGESTS A NOVEL REGULATION AS A SERINE PROTEASE. BIOCHEMISTRY V. 36 1559 1997
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
GLY A:300;
Valid;
none;
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75.067 C2 H5 N O2 C(C(=...
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90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1EXF 2.1 Å EC: 3.4.21.- EXFOLIATIVE TOXIN A STAPHYLOCOCCUS AUREUS COMPLEX (TOXIN/PEPTIDE) HYDROLASE SERINE PROTEASE SUPERANTIGEN
Ref.: THE STRUCTURE OF THE SUPERANTIGEN EXFOLIATIVE TOXIN A SUGGESTS A NOVEL REGULATION AS A SERINE PROTEASE. BIOCHEMISTRY V. 36 1559 1997
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 13 families.
1 1EXF - GLY C2 H5 N O2 C(C(=O)O)N
70% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 12 families.
1 1EXF - GLY C2 H5 N O2 C(C(=O)O)N
50% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 7 families.
1 1EXF - GLY C2 H5 N O2 C(C(=O)O)N
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: GLY; Similar ligands found: 5
No: Ligand ECFP6 Tc MDL keys Tc
1 GLY 1 1
2 BAL 0.5625 0.708333
3 ABU 0.473684 0.708333
4 MCR 0.466667 0.65
5 2RA 0.421053 0.692308
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 1EXF; Ligand: GLY; 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: 1exf.bio1) has 7 residues
No: Leader PDB Ligand Sequence Similarity
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