Receptor
PDB id Resolution Class Description Source Keywords
1JDC 1.9 Å EC: 3.2.1.60 MUTANT (E219Q) MALTOTETRAOSE-FORMING EXO-AMYLASE COCRYSTALLIZED WITH MALTOTETRAOSE (CRYSTAL TYPE 1) PSEUDOMONAS STUTZERI HYDROLASE MALTOTETRAOSE-FORMING EXO AMYLASE
Ref.: CRYSTAL STRUCTURES OF A MUTANT MALTOTETRAOSE-FORMING EXO-AMYLASE COCRYSTALLIZED WITH MALTOPENTAOSE. J.MOL.BIOL. V. 271 619 1997
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
CA A:451;
A:452;
Part of Protein;
Part of Protein;
none;
none;
submit data
40.078 Ca [Ca+2...
GLC GLC GLC GLC A:460;
Valid;
none;
submit data
648.564 n/a OCC1O...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1JDC 1.9 Å EC: 3.2.1.60 MUTANT (E219Q) MALTOTETRAOSE-FORMING EXO-AMYLASE COCRYSTALLIZED WITH MALTOTETRAOSE (CRYSTAL TYPE 1) PSEUDOMONAS STUTZERI HYDROLASE MALTOTETRAOSE-FORMING EXO AMYLASE
Ref.: CRYSTAL STRUCTURES OF A MUTANT MALTOTETRAOSE-FORMING EXO-AMYLASE COCRYSTALLIZED WITH MALTOPENTAOSE. J.MOL.BIOL. V. 271 619 1997
Members (6)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 1QI4 - MTT C24 H42 O21 C([C@@H]1[....
2 1JDC - GLC GLC GLC GLC n/a n/a
3 1QPK - MTT C24 H42 O21 C([C@@H]1[....
4 1QI3 - MTT C24 H42 O21 C([C@@H]1[....
5 1JDD - GLC GLC GLC GLC n/a n/a
6 1QI5 - MTT C24 H42 O21 C([C@@H]1[....
70% Homology Family (6)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 1QI4 - MTT C24 H42 O21 C([C@@H]1[....
2 1JDC - GLC GLC GLC GLC n/a n/a
3 1QPK - MTT C24 H42 O21 C([C@@H]1[....
4 1QI3 - MTT C24 H42 O21 C([C@@H]1[....
5 1JDD - GLC GLC GLC GLC n/a n/a
6 1QI5 - MTT C24 H42 O21 C([C@@H]1[....
50% Homology Family (6)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 1QI4 - MTT C24 H42 O21 C([C@@H]1[....
2 1JDC - GLC GLC GLC GLC n/a n/a
3 1QPK - MTT C24 H42 O21 C([C@@H]1[....
4 1QI3 - MTT C24 H42 O21 C([C@@H]1[....
5 1JDD - GLC GLC GLC GLC n/a n/a
6 1QI5 - MTT C24 H42 O21 C([C@@H]1[....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: GLC GLC GLC GLC; Similar ligands found: 8
No: Ligand ECFP6 Tc MDL keys Tc
1 GLC GLC GLC GLC 1 1
2 RCD 0.510638 0.939394
3 BCD 0.510638 0.939394
4 GLC GLC GLC GLC GLC GLC 0.510638 0.939394
5 GLC GLC GLC GLC GLC GLC GLC 0.510638 0.939394
6 GLC GLC GLC GLC GLC GLC GLC GLC 0.510638 0.939394
7 ACX 0.510638 0.939394
8 4PW 0.5 0.777778
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 1JDC; 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: 1jdc.bio1) has 23 residues
No: Leader PDB Ligand Sequence Similarity
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