Receptor
PDB id Resolution Class Description Source Keywords
3G19 1.85 Å EC: 3.-.-.- THE STRUCTURE OF THE CAULOBACTER CRESCENTUS CLPS PROTEASE ADAPTOR PROTEIN IN COMPLEX WITH LLL TRIPEPTIDE CAULOBACTER VIBRIOIDES ADAPTOR PROTEIN-PEPTIDE COMPLEX PEPTIDE-BINDING PROTEIN PEPTIDE BINDING PROTEIN
Ref.: MOLECULAR BASIS OF SUBSTRATE SELECTION BY THE N-END RULE ADAPTOR PROTEIN CLPS. PROC.NATL.ACAD.SCI.USA V. 106 8888 2009
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
LEU LEU LEU C:1;
Valid;
none;
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357.495 n/a O=C([...
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90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
3DNJ 1.15 Å EC: 3.-.-.- THE STRUCTURE OF THE CAULOBACTER CRESCENTUS CLPS PROTEASE AD PROTEIN IN COMPLEX WITH A N-END RULE PEPTIDE CAULOBACTER VIBRIOIDES ADAPTOR PROTEIN-PEPTIDE COMPLEX PEPTIDE BINDING PROTEIN
Ref.: THE MOLECULAR BASIS OF N-END RULE RECOGNITION. MOL.CELL V. 32 406 2008
Members (5)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 312 families.
1 3DNJ - TYR LEU PHE VAL GLN ARG ASP SER LYS GLU n/a n/a
2 3G1B - TRP LEU PHE VAL GLN ARG ASP SER LYS GLU n/a n/a
3 3GW1 - PHE GLY GLY n/a n/a
4 3G19 - LEU LEU LEU n/a n/a
5 3GQ1 - TRP LEU PHE VAL GLN ARG ASP SER LYS GLU n/a n/a
70% Homology Family (5)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 261 families.
1 3DNJ - TYR LEU PHE VAL GLN ARG ASP SER LYS GLU n/a n/a
2 3G1B - TRP LEU PHE VAL GLN ARG ASP SER LYS GLU n/a n/a
3 3GW1 - PHE GLY GLY n/a n/a
4 3G19 - LEU LEU LEU n/a n/a
5 3GQ1 - TRP LEU PHE VAL GLN ARG ASP SER LYS GLU n/a n/a
50% Homology Family (7)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 214 families.
1 3O2B - PHE ARG SER LYS GLY GLU GLU LEU PHE THR n/a n/a
2 2WA8 Kd = 3.8 uM PHE ARG SER LYS GLY GLU GLU LEU PHE THR n/a n/a
3 3DNJ - TYR LEU PHE VAL GLN ARG ASP SER LYS GLU n/a n/a
4 3G1B - TRP LEU PHE VAL GLN ARG ASP SER LYS GLU n/a n/a
5 3GW1 - PHE GLY GLY n/a n/a
6 3G19 - LEU LEU LEU n/a n/a
7 3GQ1 - TRP LEU PHE VAL GLN ARG ASP SER LYS GLU n/a n/a
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: LEU LEU LEU; Similar ligands found: 12
No: Ligand ECFP6 Tc MDL keys Tc
1 LEU LEU LEU 1 1
2 ALA LEU ALA LEU 0.576923 1
3 LEU LYS THR LYS LEU LEU 0.567164 0.711111
4 ALA LEU 0.533333 0.90625
5 LYS LEU LYS 0.517241 0.8
6 GLU ASP LEU 0.508772 0.888889
7 LYS THR LYS LEU LEU 0.471429 0.711111
8 LYS ASN LEU 0.467742 0.744186
9 LEU ALA SER LEU GLU SER GLN SER 0.434211 0.727273
10 GLN LEU ALA 0.409836 0.857143
11 GLY LEU 0.408163 0.756757
12 HIS GLU GLU LEU ALA LYS LEU 0.4 0.8
Similar Ligands (3D)
Ligand no: 1; Ligand: LEU LEU LEU; 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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