Receptor
PDB id Resolution Class Description Source Keywords
2QUN 2.06 Å EC: 5.3.1.- CRYSTAL STRUCTURE OF D-TAGATOSE 3-EPIMERASE FROM PSEUDOMONAS CICHORII IN COMPLEX WITH D-FRUCTOSE PSEUDOMONAS CICHORII BETA/ALPHA BARREL ISOMERASE
Ref.: CRYSTAL STRUCTURES OF D-TAGATOSE 3-EPIMERASE FROM PSEUDOMONAS CICHORII AND ITS COMPLEXES WITH D-TAGATOSE AND D-FRUCTOSE J.MOL.BIOL. V. 374 443 2007
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
FUD A:291;
B:291;
C:291;
D:291;
Valid;
Valid;
Valid;
Valid;
none;
none;
none;
none;
submit data
180.156 C6 H12 O6 C([C@...
MN A:292;
B:292;
C:292;
D:292;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
none;
none;
none;
none;
submit data
54.938 Mn [Mn+2...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
2QUN 2.06 Å EC: 5.3.1.- CRYSTAL STRUCTURE OF D-TAGATOSE 3-EPIMERASE FROM PSEUDOMONAS CICHORII IN COMPLEX WITH D-FRUCTOSE PSEUDOMONAS CICHORII BETA/ALPHA BARREL ISOMERASE
Ref.: CRYSTAL STRUCTURES OF D-TAGATOSE 3-EPIMERASE FROM PSEUDOMONAS CICHORII AND ITS COMPLEXES WITH D-TAGATOSE AND D-FRUCTOSE J.MOL.BIOL. V. 374 443 2007
Members (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 5 families.
1 2QUN - FUD C6 H12 O6 C([C@H]([C....
2 2QUM - TAG C6 H12 O6 C([C@H]([C....
70% Homology Family (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 4 families.
1 2QUN - FUD C6 H12 O6 C([C@H]([C....
2 2QUM - TAG C6 H12 O6 C([C@H]([C....
50% Homology Family (6)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 3 families.
1 3VNJ - PSJ C6 H12 O6 C([C@H]([C....
2 3VNM - SDD C6 H12 O6 C([C@H]([C....
3 3VNK - FUD C6 H12 O6 C([C@H]([C....
4 3VNL - TAG C6 H12 O6 C([C@H]([C....
5 2QUN - FUD C6 H12 O6 C([C@H]([C....
6 2QUM - TAG C6 H12 O6 C([C@H]([C....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: FUD; Similar ligands found: 17
No: Ligand ECFP6 Tc MDL keys Tc
1 TAG 1 1
2 SDD 1 1
3 SOL 1 1
4 LPK 1 1
5 FUD 1 1
6 PSJ 1 1
7 QDK 0.551724 0.956522
8 RBL 0.551724 0.956522
9 XUL 0.551724 0.956522
10 F6R 0.5 0.628571
11 TG6 0.5 0.628571
12 3MF 0.432432 0.846154
13 5FX 0.424242 0.88
14 LER 0.413793 0.956522
15 CS2 0.411765 0.913043
16 GCO 0.411765 0.913043
17 I22 0.404762 0.628571
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 2QUN; Ligand: FUD; 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: 2qun.bio1) has 19 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 2QUN; Ligand: FUD; 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: 2qun.bio1) has 17 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 3; Query (leader) PDB : 2QUN; Ligand: FUD; Similar sites found with APoc: 1
This union binding pocket(no: 3) in the query (biounit: 2qun.bio2) has 19 residues
No: Leader PDB Ligand Sequence Similarity
1 5H1W LER 39.3103
Pocket No.: 4; Query (leader) PDB : 2QUN; Ligand: FUD; Similar sites found with APoc: 1
This union binding pocket(no: 4) in the query (biounit: 2qun.bio2) has 19 residues
No: Leader PDB Ligand Sequence Similarity
1 5H1W LER 39.3103
APoc FAQ
Feedback