Receptor
PDB id Resolution Class Description Source Keywords
3VP6 2.1 Å EC: 4.1.1.15 STRUCTURAL CHARACTERIZATION OF GLUTAMIC ACID DECARBOXYLASE; INTO THE MECHANISM OF AUTOINACTIVATION HOMO SAPIENS CATALYTIC LOOP SWAP LYASE
Ref.: STRUCTURAL CHARACTERIZATION OF THE MECHANISM THROUG HUMAN GLUTAMIC ACID DECARBOXYLASE AUTO-ACTIVATES BIOSCI.REP. V. 33 137 2013
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
HLD B:1001;
A:1001;
Valid;
Valid;
none;
none;
submit data
184.103 C7 H4 O6 C1=C(...
GOL B:1002;
B:1003;
Invalid;
Invalid;
none;
none;
submit data
92.094 C3 H8 O3 C(C(C...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
3VP6 2.1 Å EC: 4.1.1.15 STRUCTURAL CHARACTERIZATION OF GLUTAMIC ACID DECARBOXYLASE; INTO THE MECHANISM OF AUTOINACTIVATION HOMO SAPIENS CATALYTIC LOOP SWAP LYASE
Ref.: STRUCTURAL CHARACTERIZATION OF THE MECHANISM THROUG HUMAN GLUTAMIC ACID DECARBOXYLASE AUTO-ACTIVATES BIOSCI.REP. V. 33 137 2013
Members (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 3 families.
1 3VP6 - HLD C7 H4 O6 C1=C(OC(=C....
2 2OKJ - ABU PLZ n/a n/a
70% Homology Family (3)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 2OKK - ABU C4 H9 N O2 C(CC(=O)O)....
2 3VP6 - HLD C7 H4 O6 C1=C(OC(=C....
3 2OKJ - ABU PLZ n/a n/a
50% Homology Family (3)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 2OKK - ABU C4 H9 N O2 C(CC(=O)O)....
2 3VP6 - HLD C7 H4 O6 C1=C(OC(=C....
3 2OKJ - ABU PLZ n/a n/a
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: HLD; Similar ligands found: 2
No: Ligand ECFP6 Tc MDL keys Tc
1 HLD 1 1
2 0GZ 0.405405 0.913043
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 3VP6; Ligand: HLD; 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: 3vp6.bio1) has 13 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 3VP6; Ligand: HLD; 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: 3vp6.bio1) has 26 residues
No: Leader PDB Ligand Sequence Similarity
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