Receptor
PDB id Resolution Class Description Source Keywords
1Q6I 2.25 Å EC: 5.2.1.8 CRYSTAL STRUCTURE OF A TRUNCATED FORM OF FKPA FROM ESCHERICH IN COMPLEX WITH IMMUNOSUPPRESSANT FK506 ESCHERICHIA COLI CHAPERONE PEPTIDYL-PROLYL ISOMERASE HEAT SHOCK PROTEIN FKFAMILY IMMUNOSUPPRESSANT FK506 ASCOMYCIN ISOMERASE
Ref.: STRUCTURAL AND FUNCTIONAL STUDIES OF FKPA FROM ESCH COLI, A CIS/TRANS PEPTIDYL-PROLYL ISOMERASE WITH CH ACTIVITY. J.MOL.BIOL. V. 335 595 2004
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
FK5 A:301;
B:401;
 Valid;
Valid;
 none;
none;
 submit data
804.018 C44 H69 N O12 C[C@@...
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90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1Q6I 2.25 Å EC: 5.2.1.8 CRYSTAL STRUCTURE OF A TRUNCATED FORM OF FKPA FROM ESCHERICH IN COMPLEX WITH IMMUNOSUPPRESSANT FK506 ESCHERICHIA COLI CHAPERONE PEPTIDYL-PROLYL ISOMERASE HEAT SHOCK PROTEIN FKFAMILY IMMUNOSUPPRESSANT FK506 ASCOMYCIN ISOMERASE
Ref.: STRUCTURAL AND FUNCTIONAL STUDIES OF FKPA FROM ESCH COLI, A CIS/TRANS PEPTIDYL-PROLYL ISOMERASE WITH CH ACTIVITY. J.MOL.BIOL. V. 335 595 2004
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 30 families.
1 1Q6I - FK5 C44 H69 N O12 C[C@@H]1C[....
70% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 20 families.
1 1Q6I - FK5 C44 H69 N O12 C[C@@H]1C[....
50% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 13 families.
1 1Q6I - FK5 C44 H69 N O12 C[C@@H]1C[....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: FK5; Similar ligands found: 4
No: Ligand ECFP6 Tc MDL keys Tc
1 FK5 1 1
2 FKA 0.746667 0.871429
3 818 0.714286 0.968254
4 858 0.660494 0.847222
Similar Ligands (3D)
Ligand no: 1; Ligand: FK5; 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 : 1Q6I; Ligand: FK5; 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: 1q6i.bio1) has 15 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 1Q6I; Ligand: FK5; 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: 1q6i.bio1) has 14 residues
No: Leader PDB Ligand Sequence Similarity
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