Receptor
PDB id Resolution Class Description Source Keywords
1TFZ 1.8 Å EC: 1.13.11.27 STRUCTURAL BASIS FOR HERBICIDAL INHIBITOR SELECTIVITY REVEAL COMPARISON OF CRYSTAL STRUCTURES OF PLANT AND MAMMALIAN 4- H YDROXYPHENYLPYRUVATE DIOXYGENASES ARABIDOPSIS THALIANA ARABIDOPSIS THALIANA 4-HYDROXYPHENYLPYRUVATE DIOXYGENASE HATHPPD OXIDOREDUCTASE
Ref.: STRUCTURAL BASIS FOR HERBICIDAL INHIBITOR SELECTIVI REVEALED BY COMPARISON OF CRYSTAL STRUCTURES OF PLA MAMMALIAN 4-HYDROXYPHENYLPYRUVATE DIOXYGENASES BIOCHEMISTRY V. 43 10414 2004
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
869 A:551;
Valid;
none;
ic50 = 7 nM
442.528 C23 H26 N2 O5 S Cc1c(...
FE A:425;
Part of Protein;
none;
submit data
55.845 Fe [Fe+3...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1TFZ 1.8 Å EC: 1.13.11.27 STRUCTURAL BASIS FOR HERBICIDAL INHIBITOR SELECTIVITY REVEAL COMPARISON OF CRYSTAL STRUCTURES OF PLANT AND MAMMALIAN 4- H YDROXYPHENYLPYRUVATE DIOXYGENASES ARABIDOPSIS THALIANA ARABIDOPSIS THALIANA 4-HYDROXYPHENYLPYRUVATE DIOXYGENASE HATHPPD OXIDOREDUCTASE
Ref.: STRUCTURAL BASIS FOR HERBICIDAL INHIBITOR SELECTIVI REVEALED BY COMPARISON OF CRYSTAL STRUCTURES OF PLA MAMMALIAN 4-HYDROXYPHENYLPYRUVATE DIOXYGENASES BIOCHEMISTRY V. 43 10414 2004
Members (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 1TFZ ic50 = 7 nM 869 C23 H26 N2 O5 S Cc1c(ccc(c....
2 1TG5 ic50 = 12 nM 645 C21 H19 Cl3 N2 O4 S CC(C)(C)n1....
70% Homology Family (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 1TFZ ic50 = 7 nM 869 C23 H26 N2 O5 S Cc1c(ccc(c....
2 1TG5 ic50 = 12 nM 645 C21 H19 Cl3 N2 O4 S CC(C)(C)n1....
50% Homology Family (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 1TFZ ic50 = 7 nM 869 C23 H26 N2 O5 S Cc1c(ccc(c....
2 1TG5 ic50 = 12 nM 645 C21 H19 Cl3 N2 O4 S CC(C)(C)n1....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: 869; Similar ligands found: 1
No: Ligand ECFP6 Tc MDL keys Tc
1 869 1 1
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 1TFZ; Ligand: 869; 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: 1tfz.bio1) has 22 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 1TFZ; Ligand: 869; 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: 1tfz.bio1) has 22 residues
No: Leader PDB Ligand Sequence Similarity
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