Receptor
PDB id Resolution Class Description Source Keywords
4BTV 1.59 Å EC: 3.1.1.75 STRUCTURE OF PHAZ7 PHB DEPOLYMERASE IN COMPLEX WITH 3HB TRIM PAUCIMONAS LEMOIGNEI HYDROLASE CATALYTIC TRIAD
Ref.: BIOCHEMICAL ANALYSIS AND STRUCTURE DETERMINATION OF PAUCIMONAS LEMOIGNEI POLY(3-HYDROXYBUTYRATE) (PHB) DEPOLYMERASE PHAZ7 MUTEINS REVEAL THE PHB BINDING S DETAILS OF SUBSTRATE-ENZYME INTERACTIONS. MOL.MICROBIOL. V. 90 649 2013
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
RB3 A:1345;
B:1343;
Valid;
Valid;
none;
none;
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290.31 C13 H22 O7 C[C@H...
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90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
4BTV 1.59 Å EC: 3.1.1.75 STRUCTURE OF PHAZ7 PHB DEPOLYMERASE IN COMPLEX WITH 3HB TRIM PAUCIMONAS LEMOIGNEI HYDROLASE CATALYTIC TRIAD
Ref.: BIOCHEMICAL ANALYSIS AND STRUCTURE DETERMINATION OF PAUCIMONAS LEMOIGNEI POLY(3-HYDROXYBUTYRATE) (PHB) DEPOLYMERASE PHAZ7 MUTEINS REVEAL THE PHB BINDING S DETAILS OF SUBSTRATE-ENZYME INTERACTIONS. MOL.MICROBIOL. V. 90 649 2013
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 4BTV - RB3 C13 H22 O7 C[C@H](CC(....
70% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 4BTV - RB3 C13 H22 O7 C[C@H](CC(....
50% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 4BTV - RB3 C13 H22 O7 C[C@H](CC(....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: RB3; Similar ligands found: 1
No: Ligand ECFP6 Tc MDL keys Tc
1 RB3 1 1
Similar Ligands (3D)
Ligand no: 1; Ligand: RB3; Similar ligands found: 0
No: Ligand Similarity coefficient
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 4BTV; Ligand: RB3; 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: 4btv.bio2) has 13 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 4BTV; Ligand: RB3; 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: 4btv.bio1) has 13 residues
No: Leader PDB Ligand Sequence Similarity
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