Receptor
PDB id Resolution Class Description Source Keywords
2CWG 2 Å NON-ENZYME: BINDING CRYSTALLOGRAPHIC REFINEMENT AND STRUCTURE ANALYSIS OF THE COMPLEX OF WHEAT GERM AGGLUTININ WITH A BIVALENT S IALOGLYCOPEPTIDE FROM GLYCOPHORIN A TRITICUM AESTIVUM LECTIN(AGGLUTININ)
Ref.: CRYSTALLOGRAPHIC REFINEMENT AND STRUCTURE ANALYSIS OF THE COMPLEX OF WHEAT GERM AGGLUTININ WITH A BIVALENT SIALOGLYCOPEPTIDE FROM GLYCOPHORIN A. J.MOL.BIOL. V. 232 620 1993
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
ASP THR TYR ALA ALA THR PRO ARG E:5;
Valid;
none;
submit data
272.325 n/a O=C(N...
SIA GAL NDG SIA B:172;
Invalid;
none;
submit data
947.847 n/a O=C([...
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90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
2CWG 2 Å NON-ENZYME: BINDING CRYSTALLOGRAPHIC REFINEMENT AND STRUCTURE ANALYSIS OF THE COMPLEX OF WHEAT GERM AGGLUTININ WITH A BIVALENT S IALOGLYCOPEPTIDE FROM GLYCOPHORIN A TRITICUM AESTIVUM LECTIN(AGGLUTININ)
Ref.: CRYSTALLOGRAPHIC REFINEMENT AND STRUCTURE ANALYSIS OF THE COMPLEX OF WHEAT GERM AGGLUTININ WITH A BIVALENT SIALOGLYCOPEPTIDE FROM GLYCOPHORIN A. J.MOL.BIOL. V. 232 620 1993
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 473 families.
1 2CWG - ASP THR TYR ALA ALA THR PRO ARG n/a n/a
70% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 355 families.
1 2CWG - ASP THR TYR ALA ALA THR PRO ARG n/a n/a
50% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 272 families.
1 2CWG - ASP THR TYR ALA ALA THR PRO ARG n/a n/a
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: ASP THR TYR ALA ALA THR PRO ARG; Similar ligands found: 11
No: Ligand ECFP6 Tc MDL keys Tc
1 ASP THR TYR ALA ALA THR PRO ARG 1 1
2 GLU THR LEU LEU ASP LEU ASP PHE ASP PRO 0.44 0.79661
3 ALA THR PRO PHE GLN GLU 0.428571 0.903846
4 SER TYR SER PRO THR SEP PRO SER 0.417582 0.730159
5 PRO SER TYR SEP PRO THR SEP PRO SER 0.417582 0.741935
6 MET ASP PRO VAL ASP PRO ASN ILE GLU 0.413333 0.719298
7 ALA PRO PRO ALA 0.409091 0.72549
8 THR GLY VAL ALA LEU THR PRO PRO SER 0.408602 0.854545
9 ALA VAL ALA PHE TYR ILE PRO ASP GLN ALA 0.407767 0.75
10 ASP LEU THR ARG PRO 0.40625 0.734375
11 ARG GLU ARG SER PRO THR ARG 0.4 0.725806
Similar Binding Sites (Proteins are less than 50% similar to leader)
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