Receptor
PDB id Resolution Class Description Source Keywords
1sdz 1.78 Å NON-ENZYME: SIGNAL_HORMONE CRYSTAL STRUCTURE OF DIAP1 BIR1 BOUND TO A REAPER PEPTIDE DROSOPHILA MELANOGASTER APOPTOSIS IAP REAPER CASPASE INTERACTION
Ref.: MOLECULAR MECHANISMS OF DRICE INHIBITION BY DIAP1 AND REMOVAL OF INHIBITION BY REAPER, HID AND GRIM. NAT.STRUCT.MOL.BIOL. V. 11 420 2004
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
ALA VAL ALA PHE TYR ILE PRO ASP GLN ALA B:1;
 Valid;
 none;
 submit data
764.945 n/a O=C(N...
ZN A:155;
 Part of Protein;
 none;
 submit data
65.409 Zn [Zn+2...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1SE0 1.75 Å NON-ENZYME: SIGNAL_HORMONE CRYSTAL STRUCTURE OF DIAP1 BIR1 BOUND TO A GRIM PEPTIDE DROSOPHILA MELANOGASTER APOPTOSIS IAP BIR GRIM CASPASE
Ref.: MOLECULAR MECHANISMS OF DRICE INHIBITION BY DIAP1 AND REMOVAL OF INHIBITION BY REAPER, HID AND GRIM. NAT.STRUCT.MOL.BIOL. V. 11 420 2004
Members (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 289 families.
1 1SDZ - ALA VAL ALA PHE TYR ILE PRO ASP GLN ALA n/a n/a
2 1SE0 - ALA ILE ALA TYR PHE ILE PRO ASP GLN ALA 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 214 families.
1 1SDZ - ALA VAL ALA PHE TYR ILE PRO ASP GLN ALA n/a n/a
2 1SE0 - ALA ILE ALA TYR PHE ILE PRO ASP GLN ALA 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 181 families.
1 1SDZ - ALA VAL ALA PHE TYR ILE PRO ASP GLN ALA n/a n/a
2 1SE0 - ALA ILE ALA TYR PHE ILE PRO ASP GLN ALA n/a n/a
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: ALA VAL ALA PHE TYR ILE PRO ASP GLN ALA; Similar ligands found: 72
No: Ligand ECFP6 Tc MDL keys Tc
1 ALA VAL ALA PHE TYR ILE PRO ASP GLN ALA 1 1
2 ALA ILE ALA TYR PHE ILE PRO ASP GLN ALA 0.892157 0.983051
3 ACE ARG TYR ALA VAL VAL PRO ASP GLU 0.546875 0.833333
4 ARG VAL ILE PTR PHE VAL PRO LEU ASN ARG 0.536 0.865672
5 SER PHE PHE GLU ASP ASN PHE VAL PRO GLU 0.503759 0.794118
6 VAL TYR ILE HIS PRO PHE 0.5 0.920635
7 ALA VAL TYR ASN PHE ALA THR MET 0.496183 0.614286
8 PHE GLU ASP ASN PHE VAL PRO 0.48855 0.80303
9 PHE GLU ALA ILE PRO ALA GLU TYR LEU 0.482759 0.967213
10 SER LEU PHE ASN THR VAL ALA THR LEU TYR 0.481752 0.626866
11 ILE GLY PRO GLY ARG ALA PHE TYR VAL 0.477124 0.867647
12 ASP TYR GLU PRO ILE PRO GLU GLU ALA PHE 0.466667 0.90625
13 ILE GLY PRO GLY ARG ALA PHE TYR THR ILE 0.465409 0.816901
14 ALA GLU THR PHE TYR VAL ASP GLY 0.464567 0.646154
15 LYS LEU PRO ALA GLN PHE TYR ILE LEU 0.461039 0.936508
16 ILE GLY PRO GLY ARG ALA PHE TYR THR 0.458065 0.84058
17 ASP ILE ALA TYR TYR THR SER GLU PRO 0.453237 0.865672
18 ASN ARG PRO VAL TYR ILE PRO PRO PRO PRO 0.451852 0.919355
19 ASP PHE GLU GLU ILE PRO GLY GLU TYR LEU 0.451613 0.921875
20 GLY ALA ASP ILE PHE TYR LEU ASP GLY ALA 0.446154 0.709677
21 LYS ALA VAL TYR ASN PHE ALA THR MET 0.445255 0.608696
22 ARG TYR GLY PHE VAL ALA ASN PHE 0.443662 0.647887
23 ILE GLY PRO GLY ARG ALA PHE TYR ALA 0.441558 0.852941
24 ARG ILE PRO SER TYR ARG TYR ARG TYR 0.440559 0.805556
25 LYS PRO ILE VAL GLN TYR ASP ASN PHE 0.43949 0.880597
26 ARG GLY PRO GLY ARG ALA PHE VAL THR ILE 0.4375 0.75
27 LEU PRO SER PHE GLU THR ALA LEU 0.4375 0.791045
28 ASN ARG PRO VAL TYR ILE PRO ARG PRO PRO 0.436242 0.838235
29 ASP ILE ASN TYR TYR ALA SER GLU PRO 0.435374 0.852941
30 GLU THR PHE TYR VAL ASP GLY 0.435115 0.681818
31 ALA ILE MET PRO ALA ARG PHE TYR PRO LYS 0.434524 0.794521
32 GLU GLU TYR LEU GLN ALA PHE THR TYR 0.432624 0.6875
33 ASP PHE ALA ASN THR PHE LEU PRO 0.432624 0.848485
34 ASP TYR ILE ASN THR ASN VAL LEU PRO 0.430556 0.863636
35 PHE TYR ALA PRO GLU PRO ILE THR SER LEU 0.429487 0.855072
36 SER LEU TYR LEU THR VAL ALA THR LEU 0.426357 0.606061
37 TYR PRO PHE PHE NH2 0.42623 0.915254
38 ALA PHE ARG ILE PRO LEU THR ARG 0.423841 0.75
39 GLN ASN TYR PRO ILE VAL GLN 0.422535 0.890625
40 GLU VAL TYR GLU SER 0.421488 0.640625
41 LEU LEU PHE GLY PHE PRO VAL TYR VAL 0.42 0.935484
42 LEU LEU PHE GLY TYR PRO VAL TYR VAL 0.42 0.935484
43 TYR SER THR CYS TYR PHE ILE MET 0.419118 0.623188
44 LEU LEU TYR GLY PHE VAL ASN TYR ILE 0.41844 0.707692
45 SER ILE TYR PHE TPO PRO GLU LEU TYR ASP 0.418182 0.797297
46 LEU ALA ILE TYR SER 0.418033 0.666667
47 LEU PHE GLY TYR PRO VAL TYR VAL 0.417808 0.935484
48 DHI PRO PHE HIS LEU LEU VAL TYR 0.417722 0.90625
49 LEU GLY TYR GLY PHE VAL ASN TYR ILE 0.417266 0.707692
50 ARG GLY PRO GLY CYS ALA PHE VAL THR ILE 0.417178 0.739726
51 PHE LEU ARG GLY ARG ALA TYR VAL LEU 0.416107 0.681159
52 GLY ALA GLN THR PHE TYR VAL ASP GLY ALA 0.416058 0.681818
53 GLY ASN TYR SER PHE TYR ALA LEU 0.415385 0.647059
54 TYR PRO ASN VAL ASN ILE HIS ASN PHE 0.414013 0.867647
55 GLU SER ASP PRO ILE VAL ALA GLN TYR 0.412903 0.850746
56 ARG THR PHE SER PRO THR TYR GLY LEU 0.411392 0.794521
57 ILE PRO ALA TYR GLY VAL LEU THR ILE 0.410596 0.876923
58 ASP ILE ASN TYR TYR THR SER GLU PRO 0.409396 0.852941
59 LEU LEU PHE GLY LYS PRO VAL TYR VAL 0.409091 0.936508
60 VAL ORN LEU DPN PRO VAL ORN LEU DPN PRO 0.408451 0.854839
61 LYS PRO PHE PTR VAL ASN VAL NH2 0.407895 0.767123
62 ALA ASP PBF PTR LEU ILE PRO 0.407407 0.805556
63 ACE GLY ASN CYS PHE SER LYS PRO ARG 0.406897 0.7
64 ASP TYR ASN PRO TYR LEU LEU PHE LEU LYS 0.406667 0.865672
65 TRP GLU TYR ILE PRO ASN VAL 0.40625 0.880597
66 SER SER LEU GLU ASN PHE ALA ALA TYR VAL 0.40411 0.647059
67 ACE PHE ALA TYR M3L SER NH2 0.403101 0.704225
68 TYR TYR SER ILE ALA PRO HIS SER ILE 0.402597 0.828571
69 ARG VAL ALA GLN LEU GLU GLN VAL TYR ILE 0.401361 0.661765
70 LEU LEU TYR GLY PHE VAL ASN TYR VAL 0.4 0.692308
71 PHE LEU ALA TYR LYS 0.4 0.770492
72 LYS LEU TYR GLN ASN PRO THR THR TYR ILE 0.4 0.880597
Similar Ligands (3D)
Ligand no: 1; Ligand: ALA VAL ALA PHE TYR ILE PRO ASP GLN ALA; 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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