Receptor
PDB id Resolution Class Description Source Keywords
5K21 1.8 Å EC: 7.-.-.- PYOCYANIN DEMETHYLASE MYCOBACTERIUM FORTUITUM SUBSP. FORTUIT46621 = ATCC 6841 DEMETHYLASE PHENAZINE OXIDOREDUCTASE
Ref.: PYOCYANIN DEGRADATION BY A TAUTOMERIZING DEMETHYLAS INHIBITS PSEUDOMONAS AERUGINOSA BIOFILMS. SCIENCE V. 355 170 2017
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
CA B:202;
C:202;
A:202;
Part of Protein;
Part of Protein;
Part of Protein;
none;
none;
none;
submit data
40.078 Ca [Ca+2...
6QF A:201;
B:201;
C:201;
Valid;
Valid;
Valid;
none;
none;
none;
submit data
196.205 C12 H8 N2 O c1ccc...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
5K21 1.8 Å EC: 7.-.-.- PYOCYANIN DEMETHYLASE MYCOBACTERIUM FORTUITUM SUBSP. FORTUIT46621 = ATCC 6841 DEMETHYLASE PHENAZINE OXIDOREDUCTASE
Ref.: PYOCYANIN DEGRADATION BY A TAUTOMERIZING DEMETHYLAS INHIBITS PSEUDOMONAS AERUGINOSA BIOFILMS. SCIENCE V. 355 170 2017
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 293 families.
1 5K21 - 6QF C12 H8 N2 O c1ccc2c(c1....
70% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 250 families.
1 5K21 - 6QF C12 H8 N2 O c1ccc2c(c1....
50% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 204 families.
1 5K21 - 6QF C12 H8 N2 O c1ccc2c(c1....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: 6QF; Similar ligands found: 1
No: Ligand ECFP6 Tc MDL keys Tc
1 6QF 1 1
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 5K21; Ligand: 6QF; 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: 5k21.bio1) has 16 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 5K21; Ligand: 6QF; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 2) in the query (biounit: 5k21.bio1) has 14 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 3; Query (leader) PDB : 5K21; Ligand: 6QF; 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: 5k21.bio1) has 16 residues
No: Leader PDB Ligand Sequence Similarity
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