Receptor
PDB id Resolution Class Description Source Keywords
2J72 1.49 Å EC: 3.2.1.41 ALPHA-GLUCAN RECOGNITION BY A FAMILY 41 CARBOHYDRATE-BINDING FROM THERMOTOGA MARITIMA PULLULANASE PULA THERMOTOGA MARITIMA CARBOHYDRATE-BINDING MODULE HYDROLASE GLYCOSIDASE MALTOTEBETA- SANDWICH FOLD ALPHA-GLUCAN BINDING
Ref.: THE STRUCTURAL BASIS OF ALPHA-GLUCAN RECOGNITION BY 41 CARBOHYDRATE-BINDING MODULE FROM THERMOTOGA MARI J.MOL.BIOL. V. 365 555 2007
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
GLC GLC GLC GLC C:1;
D:1;
 Valid;
Valid;
 none;
none;
 submit data
648.564 n/a OCC1O...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
2J73 1.4 Å EC: 3.2.1.41 ALPHA-GLUCAN RCOGNITION BY A FAMILY 41 CARBOHYDRATE-BINDING FROM THERMOTOGA MARITIMA PULLULANASE PULA THERMOTOGA MARITIMA THERMOTOGA MARITIMA ALPHA-GLUCAN BINDING GLUCOSYL-MALTOTRICARBOHYDRATE-BINDING MODULE HYDROLASE GLYCOSIDASE BETA-SFOLD
Ref.: THE STRUCTURAL BASIS OF ALPHA-GLUCAN RECOGNITION BY 41 CARBOHYDRATE-BINDING MODULE FROM THERMOTOGA MARI J.MOL.BIOL. V. 365 555 2007
Members (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 3 families.
1 2J73 - GLC GLC GLC GLC n/a n/a
2 2J72 - GLC GLC GLC GLC n/a n/a
70% Homology Family (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 3 families.
1 2J73 - GLC GLC GLC GLC n/a n/a
2 2J72 - GLC GLC GLC GLC n/a n/a
50% Homology Family (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 3 families.
1 2J73 - GLC GLC GLC GLC n/a n/a
2 2J72 - GLC GLC GLC GLC n/a n/a
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: GLC GLC GLC GLC; Similar ligands found: 5
No: Ligand ECFP6 Tc MDL keys Tc
1 GLC GLC GLC GLC 1 1
2 GLC GLC GLC GLC GLC GLC GLC 0.510638 0.939394
3 GLC GLC GLC GLC GLC GLC 0.510638 0.939394
4 GLC GLC GLC GLC GLC GLC GLC GLC 0.510638 0.939394
5 4PW 0.5 0.777778
Similar Ligands (3D)
Ligand no: 1; Ligand: GLC GLC GLC GLC; Similar ligands found: 10
No: Ligand Similarity coefficient
1 BGC GLC GLC GLC 0.9840
2 GLC GLC AC1 0.9642
3 GLC G6D ADH GLC 0.9064
4 GLC GAL GLD ACI 0.9008
5 GLC G6D ACI GLC 0.8960
6 BGC GLC AC1 0.8951
7 GLC GLC DAF 0.8904
8 GLO GLC GLC GLC 0.8881
9 GLC GLC GLC BGC 0.8817
10 SOR GLC GLC GLC 0.8761
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 2J73; Ligand: GLC GLC GLC GLC; 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: 2j73.bio1) has 10 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 2J73; Ligand: GLC GLC GLC; 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: 2j73.bio1) has 10 residues
No: Leader PDB Ligand Sequence Similarity
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