Receptor
PDB id Resolution Class Description Source Keywords
6AZT 1.8 Å EC: 7.-.-.- ASPARAGINYL ENDOPEPTIDASE 1 BOUND TO AAN PEPTIDE, A TETRAHED INTERMEDIATE HELIANTHUS ANNUUS PLANT PROTEIN
Ref.: STRUCTURAL BASIS OF RIBOSOMAL PEPTIDE MACROCYCLIZAT PLANTS. ELIFE V. 7 2018
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
GOL A:502;
A:503;
A:501;
 Invalid;
Invalid;
Invalid;
 none;
none;
none;
 submit data
92.094 C3 H8 O3 C(C(C...
ALA ALA CE7 B:1;
 Valid;
 Atoms found LESS than expected: % Diff = 0.05;
 submit data
277.301 n/a O=C(N...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
6AZT 1.8 Å EC: 7.-.-.- ASPARAGINYL ENDOPEPTIDASE 1 BOUND TO AAN PEPTIDE, A TETRAHED INTERMEDIATE HELIANTHUS ANNUUS PLANT PROTEIN
Ref.: STRUCTURAL BASIS OF RIBOSOMAL PEPTIDE MACROCYCLIZAT PLANTS. ELIFE V. 7 2018
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 319 families.
1 6AZT - ALA ALA CE7 n/a n/a
70% Homology Family (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 271 families.
1 6AZT - ALA ALA CE7 n/a n/a
2 6YSA - CIT C6 H8 O7 C(C(=O)O)C....
50% Homology Family (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 223 families.
1 6AZT - ALA ALA CE7 n/a n/a
2 6YSA - CIT C6 H8 O7 C(C(=O)O)C....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: ALA ALA CE7; Similar ligands found: 7
No: Ligand ECFP6 Tc MDL keys Tc
1 ALA ALA CE7 1 1
2 ALA ALA ALA 0.488889 0.722222
3 ALA ALA ALA ALA ALA ALA ALA 0.478261 0.722222
4 ALA ALA ALA ALA 0.42 0.666667
5 ALA ALA ALA ALA ALA 0.42 0.666667
6 ALA ALA ALA ALA SER ALA ALA 0.413793 0.825
7 ALA THR ALA ALA 0.4 0.763158
Similar Ligands (3D)
Ligand no: 1; Ligand: ALA ALA CE7; Similar ligands found: 0
No: Ligand Similarity coefficient
Similar Binding Sites (Proteins are less than 50% similar to leader) APoc FAQ
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