Receptor
PDB id Resolution Class Description Source Keywords
1QB7 1.5 Å EC: 2.-.-.- CRYSTAL STRUCTURES OF ADENINE PHOSPHORIBOSYLTRANSFERASE FROM LEISHMANIA DONOVANI. LEISHMANIA DONOVANI DINUCLEOTIDE BINDING FOLD TRANSFERASE
Ref.: CRYSTAL STRUCTURES OF ADENINE PHOSPHORIBOSYLTRANSFE LEISHMANIA DONOVANI. EMBO J. V. 18 3533 1999
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
ADE A:300;
Valid;
none;
submit data
135.127 C5 H5 N5 c1[nH...
CIT A:325;
Invalid;
none;
submit data
192.124 C6 H8 O7 C(C(=...
MG A:335;
Part of Protein;
none;
submit data
24.305 Mg [Mg+2...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1QB7 1.5 Å EC: 2.-.-.- CRYSTAL STRUCTURES OF ADENINE PHOSPHORIBOSYLTRANSFERASE FROM LEISHMANIA DONOVANI. LEISHMANIA DONOVANI DINUCLEOTIDE BINDING FOLD TRANSFERASE
Ref.: CRYSTAL STRUCTURES OF ADENINE PHOSPHORIBOSYLTRANSFE LEISHMANIA DONOVANI. EMBO J. V. 18 3533 1999
Members (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 269 families.
1 1QB8 - AMP C10 H14 N5 O7 P c1nc(c2c(n....
2 1QB7 - ADE C5 H5 N5 c1[nH]c2c(....
70% Homology Family (3)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 5 families.
1 1MZV - AMP C10 H14 N5 O7 P c1nc(c2c(n....
2 1QB8 - AMP C10 H14 N5 O7 P c1nc(c2c(n....
3 1QB7 - ADE C5 H5 N5 c1[nH]c2c(....
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 1MZV - AMP C10 H14 N5 O7 P c1nc(c2c(n....
2 1QB8 - AMP C10 H14 N5 O7 P c1nc(c2c(n....
3 1QB7 - ADE C5 H5 N5 c1[nH]c2c(....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: ADE; Similar ligands found: 6
No: Ligand ECFP6 Tc MDL keys Tc
1 ADE 1 1
2 PM6 0.5 0.742857
3 ES4 0.463415 0.685714
4 6AP 0.428571 0.9375
5 XQG 0.422222 0.648649
6 M02 0.411765 0.630435
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 1QB7; Ligand: ADE; 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: 1qb7.bio1) has 16 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 1QB7; Ligand: ADE; 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: 1qb7.bio1) has 16 residues
No: Leader PDB Ligand Sequence Similarity
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