Receptor
PDB id Resolution Class Description Source Keywords
1P6O 1.14 Å EC: 3.5.4.1 THE CRYSTAL STRUCTURE OF YEAST CYTOSINE DEAMINASE BOUND TO 4(R)-HYDROXYL-3,4-DIHYDROPYRIMIDINE AT 1.14 ANGSTROMS. SACCHAROMYCES CEREVISIAE CYTOSINE DEAMINASE HYDROLASE DIMER INHIBITOR BOUND
Ref.: THE 1.14 A CRYSTAL STRUCTURE OF YEAST CYTOSINE DEAMINASE. EVOLUTION OF NUCLEOTIDE SALVAGE ENZYMES AND IMPLICATIONS FOR GENETIC CHEMOTHERAPY. STRUCTURE V. 11 961 2003
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
ACY A:420;
B:421;
B:422;
Invalid;
Invalid;
Invalid;
none;
none;
none;
submit data
60.052 C2 H4 O2 CC(=O...
CA B:402;
B:403;
Part of Protein;
Part of Protein;
none;
none;
submit data
40.078 Ca [Ca+2...
HPY A:411;
B:410;
Valid;
Valid;
none;
none;
submit data
114.103 C4 H6 N2 O2 C1=CN...
ZN A:401;
B:400;
Part of Protein;
Part of Protein;
none;
none;
submit data
65.409 Zn [Zn+2...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1P6O 1.14 Å EC: 3.5.4.1 THE CRYSTAL STRUCTURE OF YEAST CYTOSINE DEAMINASE BOUND TO 4(R)-HYDROXYL-3,4-DIHYDROPYRIMIDINE AT 1.14 ANGSTROMS. SACCHAROMYCES CEREVISIAE CYTOSINE DEAMINASE HYDROLASE DIMER INHIBITOR BOUND
Ref.: THE 1.14 A CRYSTAL STRUCTURE OF YEAST CYTOSINE DEAMINASE. EVOLUTION OF NUCLEOTIDE SALVAGE ENZYMES AND IMPLICATIONS FOR GENETIC CHEMOTHERAPY. STRUCTURE V. 11 961 2003
Members (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 1UAQ - DUC C4 H6 N2 O2 C1CNC(=O)N....
2 1P6O - HPY C4 H6 N2 O2 C1=CNC(=O)....
70% Homology Family (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 1UAQ - DUC C4 H6 N2 O2 C1CNC(=O)N....
2 1P6O - HPY C4 H6 N2 O2 C1=CNC(=O)....
50% Homology Family (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 1UAQ - DUC C4 H6 N2 O2 C1CNC(=O)N....
2 1P6O - HPY C4 H6 N2 O2 C1=CNC(=O)....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: HPY; Similar ligands found: 1
No: Ligand ECFP6 Tc MDL keys Tc
1 HPY 1 1
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 1P6O; Ligand: HPY; Similar sites found with APoc: 2
This union binding pocket(no: 1) in the query (biounit: 1p6o.bio1) has 14 residues
No: Leader PDB Ligand Sequence Similarity
1 1VQ2 DDN 31.677
2 1VQ2 DDN 31.677
Pocket No.: 2; Query (leader) PDB : 1P6O; Ligand: HPY; Similar sites found with APoc: 2
This union binding pocket(no: 2) in the query (biounit: 1p6o.bio1) has 14 residues
No: Leader PDB Ligand Sequence Similarity
1 1VQ2 DDN 31.677
2 1VQ2 DDN 31.677
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