Receptor
PDB id Resolution Class Description Source Keywords
5G48 2.28 Å EC: 7.-.-.- H.PYLORI BETA CLAMP IN COMPLEX WITH DIFLUNISAL HELICOBACTER PYLORI TRANSFERASE DNA SLIDING CLAMP PROCESSIVITY PROMOTING FACTO
Ref.: TARGETING THE BETA-CLAMP IN HELICOBACTER PYLORI WIT FDA-APPROVED DRUGS REVEALS MICROMOLAR INHIBITION BY DIFLUNISAL. FEBS LETT. V. 591 2311 2017
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
1FL B:1375;
A:1375;
Valid;
Valid;
none;
none;
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250.198 C13 H8 F2 O3 c1cc(...
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90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
5G48 2.28 Å EC: 7.-.-.- H.PYLORI BETA CLAMP IN COMPLEX WITH DIFLUNISAL HELICOBACTER PYLORI TRANSFERASE DNA SLIDING CLAMP PROCESSIVITY PROMOTING FACTO
Ref.: TARGETING THE BETA-CLAMP IN HELICOBACTER PYLORI WIT FDA-APPROVED DRUGS REVEALS MICROMOLAR INHIBITION BY DIFLUNISAL. FEBS LETT. V. 591 2311 2017
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 311 families.
1 5G48 - 1FL C13 H8 F2 O3 c1cc(c(cc1....
70% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 266 families.
1 5G48 - 1FL C13 H8 F2 O3 c1cc(c(cc1....
50% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 218 families.
1 5G48 - 1FL C13 H8 F2 O3 c1cc(c(cc1....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: 1FL; Similar ligands found: 4
No: Ligand ECFP6 Tc MDL keys Tc
1 1FL 1 1
2 FHI 0.508772 0.965517
3 3CA 0.464286 0.931035
4 2UV 0.403509 0.69697
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 5G48; Ligand: 1FL; Similar sites found with APoc: 1
This union binding pocket(no: 1) in the query (biounit: 5g48.bio1) has 12 residues
No: Leader PDB Ligand Sequence Similarity
1 3QSB 743 42.623
Pocket No.: 2; Query (leader) PDB : 5G48; Ligand: 1FL; Similar sites found with APoc: 2
This union binding pocket(no: 2) in the query (biounit: 5g48.bio1) has 12 residues
No: Leader PDB Ligand Sequence Similarity
1 3QSB 743 42.623
2 3QSB 743 42.623
Pocket No.: 3; Query (leader) PDB : 5G48; Ligand: 1FL; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 3) in the query (biounit: 5g48.bio2) has 12 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 4; Query (leader) PDB : 5G48; Ligand: 1FL; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 4) in the query (biounit: 5g48.bio2) has 12 residues
No: Leader PDB Ligand Sequence Similarity
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