Receptor
PDB id Resolution Class Description Source Keywords
5LB7 1.5 Å NON-ENZYME: OTHER 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
350.439 n/a O=C(N...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
5LB7 1.5 Å NON-ENZYME: OTHER 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 (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1256 families.
1 5LB7 Kd = 9 uM LEU SER PRO ASP SER PHE LEU ASN ASP 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 1068 families.
1 5LB7 Kd = 9 uM LEU SER PRO ASP SER PHE LEU ASN ASP 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 922 families.
1 5LB7 Kd = 9 uM LEU SER PRO ASP SER PHE LEU ASN ASP n/a n/a
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: LEU SER PRO ASP SER PHE LEU ASN ASP; Similar ligands found: 40
No: Ligand ECFP6 Tc MDL keys Tc
1 LEU SER PRO ASP SER PHE LEU ASN ASP 1 1
2 LYS PHE LYS 0.575342 0.608696
3 ALA PHE THR SER 0.558442 0.926829
4 SER PHE ALA ASN GLY 0.535714 0.787234
5 ALA PHE THR 0.527778 0.804878
6 ASP SER GLY PHE SER PHE GLY SER LYS 0.506494 0.8
7 LYS LEU LEU PHE 0.493827 0.733333
8 ARG ILE PHE SER 0.478723 0.711538
9 ASP ASP ASP MET GLY PHE GLY LEU PHE ASP 0.472527 0.765957
10 ASP ASP MET GLY PHE GLY LEU PHE ASP 0.472527 0.765957
11 PHE LEU 0.471429 0.707317
12 LEU VAL THR LEU VAL PHE VAL 0.462366 0.902439
13 PHE LEU SER THR LYS 0.457447 0.851064
14 LDZ 0.45679 0.772727
15 ASP PHE SER ILE 0.453488 0.886364
16 SER LEU PHE ASN THR VAL ALA THR LEU TYR 0.451327 0.8
17 ASP PHE M3L THR ASP 0.44898 0.644068
18 LYS ALC LYS 0.448718 0.638298
19 TYR SER THR CYS TYR PHE ILE MET 0.444444 0.722222
20 ALA LEU ASP LEU PHE 0.4375 0.809524
21 VAL ALA PHE ARG SER 0.43299 0.72549
22 PHE SER ALA PTR VAL SER GLU GLU ASP 0.432692 0.709091
23 OIR 0.428571 0.666667
24 LEU GLU PHE GLN GLY 0.425532 0.729167
25 SER LEU PHE ASN THR VAL ALA THR LEU 0.424528 0.869565
26 SER GLU ASP GLU PHE TYR ASP ALA LEU SER 0.415929 0.75
27 TYR GLN GLU SER THR ASP PHE THR PHE LEU 0.414894 0.804348
28 ALA PHE 0.414286 0.609756
29 ALA ALA PHE 0.413333 0.7
30 PHE LEU SER TYR LYS 0.41 0.769231
31 PLH 0.407407 0.615385
32 ACE LEU PHE PHE GLK CF0 GLU 0.40625 0.66
33 ARG GLN ALA ASN PHE LEU GLY LYS ILE ASN 0.40625 0.782609
34 SER LEU PHE ASN THR ILE ALA VAL LEU 0.405405 0.833333
35 GLU THR LEU LEU ASP LEU ASP PHE LEU GLU 0.404255 0.755556
36 ACE THR VAL ALC HSO 0.40404 0.692308
37 TI1 0.402439 0.64
38 GLU THR LEU GLU ASP SER VAL PHE 0.402299 0.906977
39 TYR GLY GLY PHE LEU 0.402062 0.692308
40 THR PHE ALY SER ILE MET LYS 0.401961 0.78
Similar Binding Sites (Proteins are less than 50% similar to leader)
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