Receptor
PDB id Resolution Class Description Source Keywords
6U18 2 Å NON-ENZYME: TRANSCRIPT_TRANSLATE DIRECTED EVOLUTION OF A BIOSENSOR SELECTIVE FOR THE MACROLID ANTIBIOTIC CLARITHROMYCIN ESCHERICHIA COLI MACROLIDE BIOSENSOR DNA-BINDING DNA BINDING PROTEIN-ANTIBCOMPLEX
Ref.: DIRECTED EVOLUTION OF A BIOSENSOR SELECTIVE FOR THE MACROLIDE ANTIBIOTIC CLARITHROMYCIN TO BE PUBLISHED
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
FLC A:202;
 Invalid;
 none;
 submit data
189.1 C6 H5 O7 C(C(=...
CTY A:201;
B:201;
 Valid;
Valid;
 none;
none;
 submit data
747.953 C38 H69 N O13 CC[C@...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
3FRQ 1.76 Å NON-ENZYME: TRANSCRIPT_TRANSLATE STRUCTURE OF THE MACROLIDE BIOSENSOR PROTEIN, MPHR(A), WITH ERYTHROMCYIN ESCHERICHIA COLI MACROLIDE ANTIBIOTIC. REPRESSOR BIOSENSOR ERYTHROMYCIN STRPTOMYCES NATURAL PRODUCTS BIOSYNTHESIS DNA-BINDING TRANSCRIPTION TRANSCRIPTION REGULATION DNA BINDING PROTEI
Ref.: STRUCTURE AND FUNCTION OF THE MACROLIDE BIOSENSOR P MPHR(A), WITH AND WITHOUT ERYTHROMYCIN J.MOL.BIOL. V. 387 1250 2009
Members (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 308 families.
1 3FRQ - ERY C37 H67 N O13 CC[C@@H]1[....
2 6U18 - CTY C38 H69 N O13 CC[C@@H]1[....
70% Homology Family (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 266 families.
1 3FRQ - ERY C37 H67 N O13 CC[C@@H]1[....
2 6U18 - CTY C38 H69 N O13 CC[C@@H]1[....
50% Homology Family (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 220 families.
1 3FRQ - ERY C37 H67 N O13 CC[C@@H]1[....
2 6U18 - CTY C38 H69 N O13 CC[C@@H]1[....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: CTY; Similar ligands found: 5
No: Ligand ECFP6 Tc MDL keys Tc
1 CTY 1 1
2 ERY 0.831776 0.981481
3 ZIT 0.663934 0.881356
4 ERB 0.652542 0.962963
5 EY5 0.544715 0.981481
Similar Ligands (3D)
Ligand no: 1; Ligand: CTY; 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 : 3FRQ; Ligand: ERY; 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: 3frq.bio1) has 24 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 3FRQ; Ligand: ERY; 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: 3frq.bio1) has 23 residues
No: Leader PDB Ligand Sequence Similarity
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