Receptor
PDB id Resolution Class Description Source Keywords
3MHA 1.85 Å NON-ENZYME: OTHER CRYSTAL STRUCTURE OF LPRG FROM MYCOBACTERIUM TUBERCULOSIS BO MYCOBACTERIUM TUBERCULOSIS LIPOPROTEIN LPRG GLYCOLIPID BINDING PROTEIN LIPID BINDINGSTRUCTURAL GENOMICS TB STRUCTURAL GENOMICS CONSORTIUM TBS
Ref.: MYCOBACTERIUM TUBERCULOSIS LIPOPROTEIN LPRG (RV1411 TRIACYLATED GLYCOLIPID AGONISTS OF TOLL-LIKE RECEPT NAT.STRUCT.MOL.BIOL. V. 17 1088 2010
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
Z69 A:1;
 Valid;
 none;
 submit data
1421.85 C72 H141 O24 P CCCCC...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
3MHA 1.85 Å NON-ENZYME: OTHER CRYSTAL STRUCTURE OF LPRG FROM MYCOBACTERIUM TUBERCULOSIS BO MYCOBACTERIUM TUBERCULOSIS LIPOPROTEIN LPRG GLYCOLIPID BINDING PROTEIN LIPID BINDINGSTRUCTURAL GENOMICS TB STRUCTURAL GENOMICS CONSORTIUM TBS
Ref.: MYCOBACTERIUM TUBERCULOSIS LIPOPROTEIN LPRG (RV1411 TRIACYLATED GLYCOLIPID AGONISTS OF TOLL-LIKE RECEPT NAT.STRUCT.MOL.BIOL. V. 17 1088 2010
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1610 families.
1 3MHA - Z69 C72 H141 O24 P CCCCCCCCCC....
70% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1331 families.
1 3MHA - Z69 C72 H141 O24 P CCCCCCCCCC....
50% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1144 families.
1 3MHA - Z69 C72 H141 O24 P CCCCCCCCCC....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: Z69; Similar ligands found: 3
No: Ligand ECFP6 Tc MDL keys Tc
1 Z69 1 1
2 U2D GLC 0.554455 0.811321
3 MK0 0.417391 0.962264
Similar Ligands (3D)
Ligand no: 1; Ligand: Z69; 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 : 3MHA; Ligand: Z69; 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: 3mha.bio1) has 28 residues
No: Leader PDB Ligand Sequence Similarity
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