Receptor
PDB id Resolution Class Description Source Keywords
3ZO7 2.22 Å EC: 7.-.-.- CRYSTAL STRUCTURE OF CLCFE27A WITH SUBSTRATE RHODOCOCCUS OPACUS LYASE FERREDOXIN FOLD CHLOROCATECHOL PATHWAY DEHALOGENASE
Ref.: CRYSTAL STRUCTURE AND CATALYTIC MECHANISM OF CHLOROMUCONOLACTONE DEHALOGENASE CLCF FROM RHODOCOC OPACUS 1CP. MOL.MICROBIOL. V. 88 254 2013
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
K6H H:1093;
J:1093;
A:1093;
G:1095;
E:1092;
I:1094;
D:1092;
F:1093;
B:1095;
C:1097;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
submit data
176.554 C6 H5 Cl O4 C1=CC...
CL A:1095;
C:1095;
F:1092;
G:1096;
E:1093;
C:1096;
H:1094;
J:1094;
B:1097;
D:1093;
B:1096;
A:1094;
B:1098;
I:1093;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
submit data
35.453 Cl [Cl-]
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
3ZO7 2.22 Å EC: 7.-.-.- CRYSTAL STRUCTURE OF CLCFE27A WITH SUBSTRATE RHODOCOCCUS OPACUS LYASE FERREDOXIN FOLD CHLOROCATECHOL PATHWAY DEHALOGENASE
Ref.: CRYSTAL STRUCTURE AND CATALYTIC MECHANISM OF CHLOROMUCONOLACTONE DEHALOGENASE CLCF FROM RHODOCOC OPACUS 1CP. MOL.MICROBIOL. V. 88 254 2013
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 293 families.
1 3ZO7 - K6H C6 H5 Cl O4 C1=CC(=O)O....
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 3ZO7 - K6H C6 H5 Cl O4 C1=CC(=O)O....
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 3ZO7 - K6H C6 H5 Cl O4 C1=CC(=O)O....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: K6H; Similar ligands found: 1
No: Ligand ECFP6 Tc MDL keys Tc
1 K6H 1 1
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 3ZO7; Ligand: K6H; 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: 3zo7.bio1) has 15 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 3ZO7; Ligand: K6H; 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: 3zo7.bio1) has 14 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 3; Query (leader) PDB : 3ZO7; Ligand: K6H; 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: 3zo7.bio1) has 14 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 4; Query (leader) PDB : 3ZO7; Ligand: K6H; 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: 3zo7.bio1) has 14 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 5; Query (leader) PDB : 3ZO7; Ligand: K6H; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 5) in the query (biounit: 3zo7.bio1) has 14 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 6; Query (leader) PDB : 3ZO7; Ligand: K6H; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 6) in the query (biounit: 3zo7.bio1) has 14 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 7; Query (leader) PDB : 3ZO7; Ligand: K6H; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 7) in the query (biounit: 3zo7.bio1) has 14 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 8; Query (leader) PDB : 3ZO7; Ligand: K6H; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 8) in the query (biounit: 3zo7.bio1) has 14 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 9; Query (leader) PDB : 3ZO7; Ligand: K6H; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 9) in the query (biounit: 3zo7.bio1) has 15 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 10; Query (leader) PDB : 3ZO7; Ligand: K6H; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 10) in the query (biounit: 3zo7.bio1) has 14 residues
No: Leader PDB Ligand Sequence Similarity
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