Receptor
PDB id Resolution Class Description Source Keywords
5LB7 1.5 Å EC: 3.6.4.3 COMPLEX STRUCTURE BETWEEN P60N/P80C KATANIN AND A PEPTIDE DE ASPM MUS MUSCULUS KATANIN ASPM SEVERING ENZYME HYDROLASE
Ref.: MICROTUBULE MINUS-END REGULATION AT SPINDLE POLES B ASPM-KATANIN COMPLEX. NAT. CELL BIOL. V. 19 480 2017
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
LEU SER PRO ASP SER PHE LEU ASN ASP C:0;
 Valid;
 Atoms found LESS than expected: % Diff = 0.648;
 Kd = 9 uM
349.431 n/a O=C(N...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
5LB7 1.5 Å EC: 3.6.4.3 COMPLEX STRUCTURE BETWEEN P60N/P80C KATANIN AND A PEPTIDE DE ASPM MUS MUSCULUS KATANIN ASPM SEVERING ENZYME HYDROLASE
Ref.: MICROTUBULE MINUS-END REGULATION AT SPINDLE POLES B ASPM-KATANIN COMPLEX. NAT. CELL BIOL. V. 19 480 2017
Members (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 5OW5 - ILE GLU GLU ALA LEU GLN ILE ILE HIS SER n/a n/a
2 5LB7 Kd = 9 uM LEU SER PRO ASP SER PHE LEU ASN ASP 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 1 families.
1 5OW5 - ILE GLU GLU ALA LEU GLN ILE ILE HIS SER n/a n/a
2 5LB7 Kd = 9 uM LEU SER PRO ASP SER PHE LEU ASN ASP n/a n/a
50% Homology Family (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 5OW5 - ILE GLU GLU ALA LEU GLN ILE ILE HIS SER n/a n/a
2 5LB7 Kd = 9 uM LEU SER PRO ASP SER PHE LEU ASN ASP n/a n/a
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: LEU SER PRO ASP SER PHE LEU ASN ASP; Similar ligands found: 30
No: Ligand ECFP6 Tc MDL keys Tc
1 LEU SER PRO ASP SER PHE LEU ASN ASP 1 1
2 ALA PHE THR SER 0.512821 0.904762
3 ASP SER GLY PHE SER PHE GLY SER LYS 0.493506 0.8
4 ALA PHE THR 0.472973 0.785714
5 ASP ASP ASP MET GLY PHE GLY LEU PHE ASP 0.466667 0.75
6 ASP ASP LEU ASP VAL PRO SER PHE LEU GLN 0.464912 0.655738
7 LDZ 0.4625 0.772727
8 ARG ILE PHE SER 0.457447 0.711538
9 0FG 0.45679 0.64
10 VAL TYR ARG SER LEU SEP PHE GLU 0.45098 0.754717
11 LYS PHE LYS 0.45 0.617021
12 PHE LEU 0.444444 0.738095
13 ALA LEU ASP LEU PHE 0.443038 0.790698
14 GLY ILE LEU GLY PHE VAL PHE THR LEU 0.439252 0.795918
15 TYR SER THR CYS TYR PHE ILE MET 0.429907 0.722222
16 SER LEU PHE ASN THR ILE ALA VAL LEU 0.424779 0.851064
17 VAL ALA PHE ARG SER 0.42268 0.72549
18 LYS LEU PHE SER PHE GLY GLY 0.421053 0.816327
19 BES 0.421053 0.755556
20 ALA PHE 0.42029 0.642857
21 OIR 0.415584 0.666667
22 ACE LEU PHE 0.413333 0.744186
23 PLH 0.4125 0.615385
24 SER GLU ASP GLU PHE TYR ASP ALA LEU SER 0.412281 0.735849
25 LEU VAL THR LEU VAL PHE VAL 0.410526 0.880952
26 LYS LEU LEU PHE 0.406977 0.73913
27 GLU THR LEU GLU ASP SER VAL PHE 0.406977 0.886364
28 SER PHE ALA ASN GLY 0.406593 0.787234
29 ACE LEU PHE PHE GLK CF0 GLU 0.402299 0.66
30 ASP PHE GLU LYS GLU GLY TYR SER LEU 0.4 0.701754
Similar Ligands (3D)
Ligand no: 1; Ligand: LEU SER PRO ASP SER PHE LEU ASN ASP; 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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