Receptor
PDB id Resolution Class Description Source Keywords
5OW5 1.7 Å EC: 3.6.4.3 P60P80-CAMSAP COMPLEX MUS MUSCULUS KATANIN CAMSAP SEVERING ENZYME MICROTUBULE CYTOSKELETONHYDROLASE
Ref.: STRUCTURAL BASIS OF FORMATION OF THE MICROTUBULE MINUS-END-REGULATING CAMSAP-KATANIN COMPLEX. STRUCTURE V. 26 375 2018
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
ILE GLU GLU ALA LEU GLN ILE ILE HIS SER E:8;
F:8;
 Valid;
Valid;
 Atoms found LESS than expected: % Diff = 0.012;
Atoms found LESS than expected: % Diff = 0.012;
 submit data
1135.31 n/a O=C(N...
EDO D:101;
 Invalid;
 none;
 submit data
62.068 C2 H6 O2 C(CO)...
PEG D:102;
 Invalid;
 none;
 submit data
106.12 C4 H10 O3 C(COC...
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: ILE GLU GLU ALA LEU GLN ILE ILE HIS SER; Similar ligands found: 49
No: Ligand ECFP6 Tc MDL keys Tc
1 ILE GLU GLU ALA LEU GLN ILE ILE HIS SER 1 1
2 SER ILE ILE GLN PHE GLU HIS LEU 0.578947 0.929825
3 LYS ILE LEU HIS ARG LEU LEU GLN ASP SER 0.575342 0.868852
4 ILE LEU MET GLU HIS ILE HIS LYS LEU 0.562963 0.833333
5 HIS LYS ILE LEU HIS ARG LEU LEU GLN GLU 0.554795 0.819672
6 HIS LYS ILE LEU HIS ARG LEU LEU GLN ASP 0.541096 0.806452
7 ILE LEU ALA LYS PHE LEU HIS GLU LEU 0.532374 0.877193
8 LYS ILE LEU HIS ARG LEU LEU GLN ASP 0.531034 0.819672
9 SER HIS VAL ALA VAL GLU ASN ALA LEU 0.525926 0.910714
10 SER HIS LYS ILE ASP ASN LEU ASP 0.521429 0.913793
11 ALA ILE LEU HIS ARG LEU LEU GLN 0.510949 0.813559
12 ACE SER HIS VAL ALA VAL GLU ASN ALA LEU 0.492754 0.894737
13 HIS VAL ALA VAL GLU ASN ALA LEU 0.485075 0.836364
14 VAL GLU GLU ASP HIS VAL ALA HIS ALA 0.481481 0.836364
15 VAL LEU HIS ASP ASP LEU LEU GLU ALA 0.480315 0.836364
16 PHE ASN GLU LEU SER HIS LEU 0.48 0.927273
17 GLY HIS LYS ILE LEU HIS ARG LEU LEU GLN 0.475862 0.806452
18 ILE LEU ALA LYS PHE LEU HIS THR LEU 0.469388 0.85
19 ILE LEU ALA LYS PHE LEU HIS ARG LEU 0.453947 0.758065
20 ARG ILE ILE PRO ARG HIS LEU GLN LEU 0.446541 0.735294
21 ACE SER ALA VAL LEU HSV 0.444444 0.821429
22 SER LEU LYS ILE ASP ASN GLU ASP 0.442029 0.758621
23 LYS SER HIS GLN GLU 0.439394 0.842105
24 SER GLN LEU LYS ASN ASN ALA LYS GLU ILE 0.437956 0.775862
25 ILE GLN GLN SER ILE GLU ARG ILE 0.43609 0.704918
26 ASP GLU LEU GLU ILE LYS ALA TYR 0.427586 0.733333
27 ALA LEU PRO HIS ALA ILE LEU ARG LEU 0.425 0.731343
28 GLU LEU PRO PRO VAL LYS ILE HIS CYS 0.423529 0.78125
29 GLU LYS VAL HIS VAL GLN 0.423358 0.872727
30 ALA GLN ASP ILE TYR ARG ALA SER TYR 0.423077 0.661765
31 SER GLY ILE PHE LEU GLU THR SER 0.422222 0.741379
32 SER LEU SER GLN SER LEU SER GLN SER 0.420168 0.714286
33 HIS LYS LEU VAL GLN LEU LEU THR THR THR 0.41958 0.864407
34 LEU ALA SER LEU GLU SER GLN SER 0.419355 0.732143
35 SER GLU ILE GLU PHE ALA ARG LEU 0.418919 0.725806
36 GLU ASP GLU ASP PHE GLU ILE LEU SER LEU 0.418919 0.789474
37 ASP ALA GLU PHE ARG HIS ASP SER 0.416107 0.741935
38 GLU LEU ASP HIS TRP ALA SER 0.414474 0.87931
39 SER ALA LYS ILE ASP ASN LEU ASP 0.414286 0.758621
40 ALA SER ASN GLU HIS MET GLU THR MET 0.413793 0.836066
41 ALA LYS ARG HIS ARG LYS VAL LEU ARG ASP 0.412162 0.766667
42 SER GLU ASP GLU PHE TYR ASP ALA LEU SER 0.409396 0.721311
43 ILE LEU SER ALA LEU VAL GLY ILE VAL 0.409091 0.714286
44 THR SER THR LEU GLN GLU GLN ILE GLY TRP 0.403727 0.806452
45 VAL ASN ASP ILE PHE GLU ALA ILE 0.402778 0.701754
46 ILE LEU LYS GLU PRO VAL HIS GLY VAL 0.402439 0.806452
47 ALA ILE HIS 0.401709 0.830189
48 SER SER ILE GLU PHE ALA ARG LEU 0.401316 0.714286
49 SER LEU LEU MET TRP ILE THR GLN ALA 0.401274 0.78125
Similar Ligands (3D)
Ligand no: 1; Ligand: ILE GLU GLU ALA LEU GLN ILE ILE HIS SER; 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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