Receptor
PDB id Resolution Class Description Source Keywords
6GCC 1.9 Å EC: 2.-.-.- CRYSTAL STRUCTURE OF GLUTATHIONE TRANSFERASE XI 3 MUTANT C56 TRAMETES VERSICOLOR IN COMPLEX WITH DEXTRAN-SULFATE TRAMETES VERSICOLOR GLUTATHIONE TRANSFERASE TRANSFERASE
Ref.: TRAMETES VERSICOLOR GLUTATHIONE TRANSFERASE XI 3, A CYS-GST WITH CATALYTIC SPECIFICITIES OF BOTH XI AND CLASSES. FEBS LETT. V. 592 3163 2018
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
TUJ TUG 5LT C:1;
D:1;
 Valid;
Valid;
 none;
none;
 submit data
1136.88 n/a S(=O)...
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90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
6GCB 1.8 Å EC: 2.-.-.- CRYSTAL STRUCTURE OF GLUTATHIONE TRANSFERASE XI 3 FROM TRAME VERSICOLOR IN COMPLEX WITH GLUTATHIONE TRAMETES VERSICOLOR GLUTATHIONE TRANSFERASE TRANSFERASE
Ref.: TRAMETES VERSICOLOR GLUTATHIONE TRANSFERASE XI 3, A CYS-GST WITH CATALYTIC SPECIFICITIES OF BOTH XI AND CLASSES. FEBS LETT. V. 592 3163 2018
Members (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 313 families.
1 6GCC - TUJ TUG 5LT n/a n/a
2 6GCB - GSH C10 H17 N3 O6 S C(CC(=O)N[....
70% Homology Family (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 277 families.
1 6GCC - TUJ TUG 5LT n/a n/a
2 6GCB - GSH C10 H17 N3 O6 S C(CC(=O)N[....
50% Homology Family (3)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 212 families.
1 4USS - GSH C10 H17 N3 O6 S C(CC(=O)N[....
2 6GCC - TUJ TUG 5LT n/a n/a
3 6GCB - GSH C10 H17 N3 O6 S C(CC(=O)N[....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: TUJ TUG 5LT; Similar ligands found: 2
No: Ligand ECFP6 Tc MDL keys Tc
1 TUJ TUG 5LT 1 1
2 PDX PDX 0.405063 0.96
Similar Ligands (3D)
Ligand no: 1; Ligand: TUJ TUG 5LT; 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 : 6GCB; Ligand: GSH; Similar sites found with APoc: 2
This union binding pocket(no: 1) in the query (biounit: 6gcb.bio1) has 28 residues
No: Leader PDB Ligand Sequence Similarity
1 4AGS GSH 4
2 4AGS GSH 4
Pocket No.: 2; Query (leader) PDB : 6GCB; Ligand: GSH; Similar sites found with APoc: 2
This union binding pocket(no: 2) in the query (biounit: 6gcb.bio1) has 28 residues
No: Leader PDB Ligand Sequence Similarity
1 4AGS GSH 4
2 4AGS GSH 4
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