Receptor
PDB id Resolution Class Description Source Keywords
5N5W 1.37 Å EC: 2.7.11.1 14-3-3 SIGMA IN COMPLEX WITH TAZ PS89 PEPTIDE AND FRAGMENT N HOMO SAPIENS 14-3-3 TAZ FRAGMENT FBDD PROTEIN BINDING
Ref.: IDENTIFICATION OF TWO SECONDARY LIGAND BINDING SITE 14-3-3 PROTEINS USING FRAGMENT SCREENING. BIOCHEMISTRY V. 56 3972 2017
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
CA A:305;
 Part of Protein;
 none;
 submit data
40.078 Ca [Ca+2...
8OE A:307;
 Valid;
 none;
 submit data
255.1 C11 H8 Cl2 N2 O c1cc(...
CL A:303;
A:304;
 Invalid;
Invalid;
 none;
none;
 submit data
35.453 Cl [Cl-]
MG A:302;
A:306;
A:301;
 Part of Protein;
Part of Protein;
Invalid;
 none;
none;
none;
 submit data
24.305 Mg [Mg+2...
ARG SER HIS SEP SER PRO ALA SER LEU GLN P:86;
 Valid;
 Atoms found MORE than expected: % Diff = 1.089;
 submit data
1133.12 n/a P(=O)...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
6HHP 1.8 Å EC: 2.7.11.1 TERNARY COMPLEX OF ESTROGEN RECEPTOR ALPHA PEPTIDE AND 14-3- C42 MUTANT BOUND TO DISULFIDE FRAGMENT PPI STABILIZER 1 HOMO SAPIENS PROTEIN-PROTEIN INTERACTION FRAGMENT STABILIZER PROTEIN B
Ref.: SITE-DIRECTED FRAGMENT-BASED SCREENING FOR THE DISC PROTEIN-PROTEIN INTERACTION STABILIZERS. J. AM. CHEM. SOC. V. 141 3524 2019
Members (63)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 133 families.
1 6Y3W - LYS ARG ARG ARG LYS SEP CYS GLN ALA NH2 O85 n/a n/a
2 6HKB - ALA GLU GLY PHE PRO ALA TPO VAL n/a n/a
3 6FI5 Kd = 3 uM THR PRO SEP LEU PRO DAL 60H n/a n/a
4 5BTV Kd = 140 uM GLY SEP LEU GLY n/a n/a
5 6W0L - ALA ARG VAL SER MET ARG ARG MET SEP ASN n/a n/a
6 6XWD Kd = 2.18 uM ASN LYS ASN ALA ASN SEP SER PRO VAL n/a n/a
7 4Y32 ic50 = 90.1 uM ARG THR PRO SEP LEU PRO THR 49F n/a n/a
8 4Y5I ic50 = 301.3 uM ACE ARG THR PRO SEP LEU PRO THR PIP n/a n/a
9 6FBB - SER ARG SEP SER PRO n/a n/a
10 5N5W - 8OE C11 H8 Cl2 N2 O c1cc(ccc1N....
11 6FBY Kd = 9.3 uM ACE ARG THR PRO SEP LEU PRO GLY D4H n/a n/a
12 6Y3M - GLN SER TYR TPO VAL n/a n/a
13 6HHP Kd = 32 nM ALA GLU GLY PHE PRO ALA TPO VAL n/a n/a
14 4DHS - Y03 C14 H12 Cl2 N O5 P c1ccc(c(c1....
15 6Y3S - ASN ALA ARG SER ALA SEP PHE SER GLN GLY n/a n/a
16 6GHP - ACE LYS ARG ARG LYS SEP VAL n/a n/a
17 4DHO - Y09 C15 H16 N O6 P COc1cccc(c....
18 6Y8A - ARG SER LEU SEP ALA PRO GLY ASN n/a n/a
19 6Y8E - ARG SER PHE SEP GLU PRO PHE GLY n/a n/a
20 3IQV Kd = 6.6 uM FSC C36 H56 O12 C[C@@H]1[C....
21 4IEA Kd = 346 nM ARG SER ALA SEP GLU PRO SER LEU n/a n/a
22 6HN2 - ALA GLU GLY PHE PRO ALA TPO VAL n/a n/a
23 6Y58 Kd = 15.8 uM VAL TYR ARG SER LEU SEP PHE GLU n/a n/a
24 6FAW Kd = 2.7 uM ACE ARG THR PRO SEP LEU PRO GLY D3K n/a n/a
25 5N75 - ARG SER HIS SEP SER PRO ALA SER LEU GLN n/a n/a
26 4DHN - 0KC C13 H18 N O5 P c1ccc(c(c1....
27 3MHR - ARG ALA HIS SEP SER PRO ALA SER LEU GLN n/a n/a
28 4DHP - Y07 C15 H12 Cl F3 N O5 P c1ccc(c(c1....
29 3LW1 Kd = 16.3 uM PHE LYS TPO GLU GLY PRO ASP SER ASP n/a n/a
30 3SP5 Kd = 0.56 uM LYS ARG ARG LYS SEP VAL n/a n/a
31 4DHU - 0KH C14 H12 Cl2 N O5 P c1ccc(c(c1....
32 6HMT Kd = 92 nM ALA GLU GLY PHE PRO ALA TPO VAL n/a n/a
33 6Y1D - LYS ARG ARG ARG LYS SEP CYS GLN ALA NH2 n/a n/a
34 6XY5 - LYS ARG ARG ARG LYS SEP CYS GLN ALA O4E n/a n/a
35 3O8I - M1T C7 H14 O4 COCC(=O)CC....
36 6Y18 - LYS ARG ARG ARG LYS SEP CYS GLN ALA O68 n/a n/a
37 6TJM - NE5 C24 H16 N2 O8 c1ccc(cc1)....
38 5OEH - 9SZ C42 H32 O8 P2 c1ccc2c(c1....
39 4DHT - 0KG C14 H20 N O5 P c1ccc(c(c1....
40 6HKF - ALA GLU GLY PHE PRO ALA TPO VAL n/a n/a
41 6Y3O - ARG LYS LEU SEP LEU GLN GLU ARG n/a n/a
42 6Y8D - VAL GLU HIS SEP LEU ASP ASN LYS n/a n/a
43 5LU1 - ARG ARG ALA SEP ALA PRO LEU PRO n/a n/a
44 3IQJ Kd = 7.5 uM GLN ARG SER THR SEP THR PRO ASN VAL HIS n/a n/a
45 4FR3 Kd = 0.07 uM 0V4 C27 H44 O8 C[C@@H]1[C....
46 5HF3 Kd = 13.4 uM ACE ARG THR PRO SEP LEU PRO THR 60H n/a n/a
47 5N5R - NV1 C13 H20 N2 O Cc1cccc(c1....
48 4DHM - 0KB C15 H13 F3 N O5 P c1ccc(c(c1....
49 4DAT - SER SER PHE TYR PRO SEP ALA GLU GLY n/a n/a
50 6Y8B - TYR ASP LEU SEP LEU PRO PHE PRO n/a n/a
51 6FI4 Kd = 2.2 uM PRO SEP LEU PRO DVA 60H n/a n/a
52 3IQU - GLN ARG SER THR SEP THR n/a n/a
53 4DHQ - Y06 C14 H13 Cl N O5 P c1ccc(c(c1....
54 4DHR - Y04 C14 H13 Cl N O5 P c1ccc(c(c1....
55 4Y3B ic50 = 90.1 uM 49F C7 H15 N O COCC[C@@H]....
56 5N5T - SER HIS SEP SER PRO ALA SER LEU n/a n/a
57 6HMU - ALA GLU GLY PHE PRO ALA TPO VAL n/a n/a
58 6XXC - LYS ARG ARG ARG LYS SEP CYS GLN ALA O3W n/a n/a
59 6FBW Kd = 16.5 uM ARG THR PRO SEP LEU PRO GLY D4K n/a n/a
60 6FAV Kd = 4.7 uM ACE ARG THR PRO SEP LEU PRO GLY D3Q n/a n/a
61 5MXO - FSC C36 H56 O12 C[C@@H]1[C....
62 6TL3 - NJW C24 H17 N3 O7 c1ccc(cc1)....
63 6FAU Kd = 3.6 uM ACE ARG THR PRO SEP LEU PRO GLY D3W n/a n/a
70% Homology Family (79)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 101 families.
1 6Y3W - LYS ARG ARG ARG LYS SEP CYS GLN ALA NH2 O85 n/a n/a
2 6HKB - ALA GLU GLY PHE PRO ALA TPO VAL n/a n/a
3 6FI5 Kd = 3 uM THR PRO SEP LEU PRO DAL 60H n/a n/a
4 5BTV Kd = 140 uM GLY SEP LEU GLY n/a n/a
5 6W0L - ALA ARG VAL SER MET ARG ARG MET SEP ASN n/a n/a
6 6XWD Kd = 2.18 uM ASN LYS ASN ALA ASN SEP SER PRO VAL n/a n/a
7 4Y32 ic50 = 90.1 uM ARG THR PRO SEP LEU PRO THR 49F n/a n/a
8 4Y5I ic50 = 301.3 uM ACE ARG THR PRO SEP LEU PRO THR PIP n/a n/a
9 6FBB - SER ARG SEP SER PRO n/a n/a
10 5N5W - 8OE C11 H8 Cl2 N2 O c1cc(ccc1N....
11 6FBY Kd = 9.3 uM ACE ARG THR PRO SEP LEU PRO GLY D4H n/a n/a
12 6Y3M - GLN SER TYR TPO VAL n/a n/a
13 6HHP Kd = 32 nM ALA GLU GLY PHE PRO ALA TPO VAL n/a n/a
14 4DHS - Y03 C14 H12 Cl2 N O5 P c1ccc(c(c1....
15 6Y3S - ASN ALA ARG SER ALA SEP PHE SER GLN GLY n/a n/a
16 6GHP - ACE LYS ARG ARG LYS SEP VAL n/a n/a
17 4DHO - Y09 C15 H16 N O6 P COc1cccc(c....
18 6Y8A - ARG SER LEU SEP ALA PRO GLY ASN n/a n/a
19 6Y8E - ARG SER PHE SEP GLU PRO PHE GLY n/a n/a
20 3IQV Kd = 6.6 uM FSC C36 H56 O12 C[C@@H]1[C....
21 4IEA Kd = 346 nM ARG SER ALA SEP GLU PRO SER LEU n/a n/a
22 6HN2 - ALA GLU GLY PHE PRO ALA TPO VAL n/a n/a
23 6Y58 Kd = 15.8 uM VAL TYR ARG SER LEU SEP PHE GLU n/a n/a
24 6FAW Kd = 2.7 uM ACE ARG THR PRO SEP LEU PRO GLY D3K n/a n/a
25 5N75 - ARG SER HIS SEP SER PRO ALA SER LEU GLN n/a n/a
26 4DHN - 0KC C13 H18 N O5 P c1ccc(c(c1....
27 3MHR - ARG ALA HIS SEP SER PRO ALA SER LEU GLN n/a n/a
28 4DHP - Y07 C15 H12 Cl F3 N O5 P c1ccc(c(c1....
29 3LW1 Kd = 16.3 uM PHE LYS TPO GLU GLY PRO ASP SER ASP n/a n/a
30 3SP5 Kd = 0.56 uM LYS ARG ARG LYS SEP VAL n/a n/a
31 4DHU - 0KH C14 H12 Cl2 N O5 P c1ccc(c(c1....
32 6HMT Kd = 92 nM ALA GLU GLY PHE PRO ALA TPO VAL n/a n/a
33 6Y1D - LYS ARG ARG ARG LYS SEP CYS GLN ALA NH2 n/a n/a
34 6XY5 - LYS ARG ARG ARG LYS SEP CYS GLN ALA O4E n/a n/a
35 3O8I - M1T C7 H14 O4 COCC(=O)CC....
36 6Y18 - LYS ARG ARG ARG LYS SEP CYS GLN ALA O68 n/a n/a
37 6TJM - NE5 C24 H16 N2 O8 c1ccc(cc1)....
38 5OEH - 9SZ C42 H32 O8 P2 c1ccc2c(c1....
39 4DHT - 0KG C14 H20 N O5 P c1ccc(c(c1....
40 6HKF - ALA GLU GLY PHE PRO ALA TPO VAL n/a n/a
41 6Y3O - ARG LYS LEU SEP LEU GLN GLU ARG n/a n/a
42 6Y8D - VAL GLU HIS SEP LEU ASP ASN LYS n/a n/a
43 5LU1 - ARG ARG ALA SEP ALA PRO LEU PRO n/a n/a
44 3IQJ Kd = 7.5 uM GLN ARG SER THR SEP THR PRO ASN VAL HIS n/a n/a
45 4FR3 Kd = 0.07 uM 0V4 C27 H44 O8 C[C@@H]1[C....
46 5HF3 Kd = 13.4 uM ACE ARG THR PRO SEP LEU PRO THR 60H n/a n/a
47 5N5R - NV1 C13 H20 N2 O Cc1cccc(c1....
48 4DHM - 0KB C15 H13 F3 N O5 P c1ccc(c(c1....
49 4DAT - SER SER PHE TYR PRO SEP ALA GLU GLY n/a n/a
50 6Y8B - TYR ASP LEU SEP LEU PRO PHE PRO n/a n/a
51 6FI4 Kd = 2.2 uM PRO SEP LEU PRO DVA 60H n/a n/a
52 3IQU - GLN ARG SER THR SEP THR n/a n/a
53 4DHQ - Y06 C14 H13 Cl N O5 P c1ccc(c(c1....
54 4DHR - Y04 C14 H13 Cl N O5 P c1ccc(c(c1....
55 4Y3B ic50 = 90.1 uM 49F C7 H15 N O COCC[C@@H]....
56 5N5T - SER HIS SEP SER PRO ALA SER LEU n/a n/a
57 6HMU - ALA GLU GLY PHE PRO ALA TPO VAL n/a n/a
58 6XXC - LYS ARG ARG ARG LYS SEP CYS GLN ALA O3W n/a n/a
59 6FBW Kd = 16.5 uM ARG THR PRO SEP LEU PRO GLY D4K n/a n/a
60 6FAV Kd = 4.7 uM ACE ARG THR PRO SEP LEU PRO GLY D3Q n/a n/a
61 5MXO - FSC C36 H56 O12 C[C@@H]1[C....
62 6TL3 - NJW C24 H17 N3 O7 c1ccc(cc1)....
63 6FAU Kd = 3.6 uM ACE ARG THR PRO SEP LEU PRO GLY D3W n/a n/a
64 1QJB Ki = 416 nM ALA ARG SER HIS SEP TYR PRO ALA n/a n/a
65 6FNA - DWE C50 H66 N6 O20 P2 c1ccc(c(c1....
66 4N84 Kd = 41 nM GLY MKD LEU ASP MKD LEU ASP LEU ALA SER n/a n/a
67 1QJA Kd = 416 nM ARG LEU TYR HIS SEP LEU PRO ALA n/a n/a
68 6FNC - DWK C40 H48 N4 O15 P2 c1ccc(c(c1....
69 6FN9 ic50 = 284 uM DW8 C27 H38 N3 O10 P CCCNC(=O)C....
70 2C1N - ALA ARG LYS SEP THR GLY GLY LYS n/a n/a
71 2V7D Kd = 261 nM LYS SER ALA TPO THR THR VAL MET ASN PRO n/a n/a
72 6FNB - DWQ C59 H84 N6 O22 P2 c1ccc(c(c1....
73 3NKX Kd = 7.5 uM GLN ARG SER THR SEP THR PRO ASN VAL HIS n/a n/a
74 2BR9 - ARG ARG GLN ARG SEP ALA PRO n/a n/a
75 2C63 - ARG ALA ILE SEP LEU PRO n/a n/a
76 5NWI Kd = 0.69 uM TYR PHE SER SEP ASN n/a n/a
77 1O9D Kd = 2.5 uM GLN SER TYR TPO VAL n/a n/a
78 5NWJ - HIS LEU TYR PHE SER SEP ASN n/a n/a
79 3E6Y Kd = 2.5 uM CW1 C34 H52 O12 C[C@@H]1[C....
50% Homology Family (79)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 70 families.
1 6Y3W - LYS ARG ARG ARG LYS SEP CYS GLN ALA NH2 O85 n/a n/a
2 6HKB - ALA GLU GLY PHE PRO ALA TPO VAL n/a n/a
3 6FI5 Kd = 3 uM THR PRO SEP LEU PRO DAL 60H n/a n/a
4 5BTV Kd = 140 uM GLY SEP LEU GLY n/a n/a
5 6W0L - ALA ARG VAL SER MET ARG ARG MET SEP ASN n/a n/a
6 6XWD Kd = 2.18 uM ASN LYS ASN ALA ASN SEP SER PRO VAL n/a n/a
7 4Y32 ic50 = 90.1 uM ARG THR PRO SEP LEU PRO THR 49F n/a n/a
8 4Y5I ic50 = 301.3 uM ACE ARG THR PRO SEP LEU PRO THR PIP n/a n/a
9 6FBB - SER ARG SEP SER PRO n/a n/a
10 5N5W - 8OE C11 H8 Cl2 N2 O c1cc(ccc1N....
11 6FBY Kd = 9.3 uM ACE ARG THR PRO SEP LEU PRO GLY D4H n/a n/a
12 6Y3M - GLN SER TYR TPO VAL n/a n/a
13 6HHP Kd = 32 nM ALA GLU GLY PHE PRO ALA TPO VAL n/a n/a
14 4DHS - Y03 C14 H12 Cl2 N O5 P c1ccc(c(c1....
15 6Y3S - ASN ALA ARG SER ALA SEP PHE SER GLN GLY n/a n/a
16 6GHP - ACE LYS ARG ARG LYS SEP VAL n/a n/a
17 4DHO - Y09 C15 H16 N O6 P COc1cccc(c....
18 6Y8A - ARG SER LEU SEP ALA PRO GLY ASN n/a n/a
19 6Y8E - ARG SER PHE SEP GLU PRO PHE GLY n/a n/a
20 3IQV Kd = 6.6 uM FSC C36 H56 O12 C[C@@H]1[C....
21 4IEA Kd = 346 nM ARG SER ALA SEP GLU PRO SER LEU n/a n/a
22 6HN2 - ALA GLU GLY PHE PRO ALA TPO VAL n/a n/a
23 6Y58 Kd = 15.8 uM VAL TYR ARG SER LEU SEP PHE GLU n/a n/a
24 6FAW Kd = 2.7 uM ACE ARG THR PRO SEP LEU PRO GLY D3K n/a n/a
25 5N75 - ARG SER HIS SEP SER PRO ALA SER LEU GLN n/a n/a
26 4DHN - 0KC C13 H18 N O5 P c1ccc(c(c1....
27 3MHR - ARG ALA HIS SEP SER PRO ALA SER LEU GLN n/a n/a
28 4DHP - Y07 C15 H12 Cl F3 N O5 P c1ccc(c(c1....
29 3LW1 Kd = 16.3 uM PHE LYS TPO GLU GLY PRO ASP SER ASP n/a n/a
30 3SP5 Kd = 0.56 uM LYS ARG ARG LYS SEP VAL n/a n/a
31 4DHU - 0KH C14 H12 Cl2 N O5 P c1ccc(c(c1....
32 6HMT Kd = 92 nM ALA GLU GLY PHE PRO ALA TPO VAL n/a n/a
33 6Y1D - LYS ARG ARG ARG LYS SEP CYS GLN ALA NH2 n/a n/a
34 6XY5 - LYS ARG ARG ARG LYS SEP CYS GLN ALA O4E n/a n/a
35 3O8I - M1T C7 H14 O4 COCC(=O)CC....
36 6Y18 - LYS ARG ARG ARG LYS SEP CYS GLN ALA O68 n/a n/a
37 6TJM - NE5 C24 H16 N2 O8 c1ccc(cc1)....
38 5OEH - 9SZ C42 H32 O8 P2 c1ccc2c(c1....
39 4DHT - 0KG C14 H20 N O5 P c1ccc(c(c1....
40 6HKF - ALA GLU GLY PHE PRO ALA TPO VAL n/a n/a
41 6Y3O - ARG LYS LEU SEP LEU GLN GLU ARG n/a n/a
42 6Y8D - VAL GLU HIS SEP LEU ASP ASN LYS n/a n/a
43 5LU1 - ARG ARG ALA SEP ALA PRO LEU PRO n/a n/a
44 3IQJ Kd = 7.5 uM GLN ARG SER THR SEP THR PRO ASN VAL HIS n/a n/a
45 4FR3 Kd = 0.07 uM 0V4 C27 H44 O8 C[C@@H]1[C....
46 5HF3 Kd = 13.4 uM ACE ARG THR PRO SEP LEU PRO THR 60H n/a n/a
47 5N5R - NV1 C13 H20 N2 O Cc1cccc(c1....
48 4DHM - 0KB C15 H13 F3 N O5 P c1ccc(c(c1....
49 4DAT - SER SER PHE TYR PRO SEP ALA GLU GLY n/a n/a
50 6Y8B - TYR ASP LEU SEP LEU PRO PHE PRO n/a n/a
51 6FI4 Kd = 2.2 uM PRO SEP LEU PRO DVA 60H n/a n/a
52 3IQU - GLN ARG SER THR SEP THR n/a n/a
53 4DHQ - Y06 C14 H13 Cl N O5 P c1ccc(c(c1....
54 4DHR - Y04 C14 H13 Cl N O5 P c1ccc(c(c1....
55 4Y3B ic50 = 90.1 uM 49F C7 H15 N O COCC[C@@H]....
56 5N5T - SER HIS SEP SER PRO ALA SER LEU n/a n/a
57 6HMU - ALA GLU GLY PHE PRO ALA TPO VAL n/a n/a
58 6XXC - LYS ARG ARG ARG LYS SEP CYS GLN ALA O3W n/a n/a
59 6FBW Kd = 16.5 uM ARG THR PRO SEP LEU PRO GLY D4K n/a n/a
60 6FAV Kd = 4.7 uM ACE ARG THR PRO SEP LEU PRO GLY D3Q n/a n/a
61 5MXO - FSC C36 H56 O12 C[C@@H]1[C....
62 6TL3 - NJW C24 H17 N3 O7 c1ccc(cc1)....
63 6FAU Kd = 3.6 uM ACE ARG THR PRO SEP LEU PRO GLY D3W n/a n/a
64 1QJB Ki = 416 nM ALA ARG SER HIS SEP TYR PRO ALA n/a n/a
65 6FNA - DWE C50 H66 N6 O20 P2 c1ccc(c(c1....
66 4N84 Kd = 41 nM GLY MKD LEU ASP MKD LEU ASP LEU ALA SER n/a n/a
67 1QJA Kd = 416 nM ARG LEU TYR HIS SEP LEU PRO ALA n/a n/a
68 6FNC - DWK C40 H48 N4 O15 P2 c1ccc(c(c1....
69 6FN9 ic50 = 284 uM DW8 C27 H38 N3 O10 P CCCNC(=O)C....
70 2C1N - ALA ARG LYS SEP THR GLY GLY LYS n/a n/a
71 2V7D Kd = 261 nM LYS SER ALA TPO THR THR VAL MET ASN PRO n/a n/a
72 6FNB - DWQ C59 H84 N6 O22 P2 c1ccc(c(c1....
73 3NKX Kd = 7.5 uM GLN ARG SER THR SEP THR PRO ASN VAL HIS n/a n/a
74 2BR9 - ARG ARG GLN ARG SEP ALA PRO n/a n/a
75 2C63 - ARG ALA ILE SEP LEU PRO n/a n/a
76 5NWI Kd = 0.69 uM TYR PHE SER SEP ASN n/a n/a
77 1O9D Kd = 2.5 uM GLN SER TYR TPO VAL n/a n/a
78 5NWJ - HIS LEU TYR PHE SER SEP ASN n/a n/a
79 3E6Y Kd = 2.5 uM CW1 C34 H52 O12 C[C@@H]1[C....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: 8OE; Similar ligands found: 3
No: Ligand ECFP6 Tc MDL keys Tc
1 8OE 1 1
2 8OB 0.673913 0.777778
3 O0D 0.54386 0.666667
Ligand no: 2; Ligand: ARG SER HIS SEP SER PRO ALA SER LEU GLN; Similar ligands found: 79
No: Ligand ECFP6 Tc MDL keys Tc
1 ARG SER HIS SEP SER PRO ALA SER LEU GLN 1 1
2 SER HIS SEP SER PRO ALA SER LEU GLN 0.847222 0.945946
3 SER HIS SEP SER PRO ALA SER LEU 0.693333 0.932432
4 ARG ALA HIS SEP SER PRO ALA SER LEU GLN 0.686667 0.92
5 ARG LEU TYR HIS SEP LEU PRO ALA 0.652439 0.911392
6 ALA ARG SER HIS SEP TYR PRO ALA 0.607143 0.898734
7 ARG SER ALA SEP GLU PRO SER LEU 0.590062 0.933333
8 ARG SER LEU SEP ALA PRO GLY ASN 0.574194 0.92
9 HIS HIS ALA SER PRO ARG LYS 0.567073 0.826667
10 ARG ILE ILE PRO ARG HIS LEU GLN LEU 0.538012 0.828947
11 ARG ARG ALA SEP ALA PRO LEU PRO 0.5 0.906667
12 ARG GLN ALA SEP ILE GLU LEU PRO SER MET 0.494681 0.875
13 LYS ARG ARG ARG HIS PRO SER 0.493902 0.824324
14 ARG SEP PRO VAL PHE SER 0.491228 0.893333
15 LYS ARG ARG ARG HIS PRO SER GLY 0.491018 0.864865
16 ALA ILE LEU HIS ARG LEU LEU GLN 0.490683 0.706667
17 ALA LEU PRO HIS ALA ILE LEU ARG LEU 0.482955 0.802632
18 ARG THR PRO SEP LEU PRO THR 0.481707 0.92
19 ARG THR PRO SEP LEU PRO THR 49F 0.481707 0.92
20 ARG GLN PRO ALA LYS ALA PRO LEU LEU 0.461988 0.789474
21 ACE PRO LEU HIS SER TPO ALA NH2 0.460606 0.896104
22 ARG VAL ALA SEP PRO THR SER GLY VAL 0.45977 0.894737
23 SER ARG ASP HIS SER ARG THR PRO MET 0.459459 0.8375
24 ARG ILE PRO SER TYR ARG TYR ARG TYR 0.458824 0.790123
25 LEU PRO PHE GLU LEU ARG GLY HIS LEU VAL 0.449735 0.805195
26 PHE PRO ARG PRO TRP LEU HIS GLY LEU 0.44898 0.797468
27 ARG GLN TRP GLY PRO ASP PRO ALA ALA VAL 0.446701 0.794872
28 MET HIS PRO ALA GLN THR SER GLN TRP 0.443299 0.746988
29 PHE SER HIS PRO GLN ASN THR 0.443182 0.769231
30 ACE PRO LEU HIS SER TPO 0.441718 0.871795
31 ARG LEU PRO ALA LYS ALA PRO LEU LEU 0.441176 0.776316
32 LYS VAL ALA PRO PRO ILE PRO HIS ARG 0.44086 0.802632
33 SER HIS PRO ARG PRO ILE ARG VAL 0.440678 0.881579
34 HCI PRO LEU HIS SER TPO ALA NH2 0.438889 0.909091
35 SER THR GLY GLY VAL M3L LYS PRO HIS ARG 0.437811 0.8625
36 LYS ILE LEU HIS ARG LEU LEU GLN ASP SER 0.437158 0.776316
37 HIS LYS ILE LEU HIS ARG LEU LEU GLN GLU 0.436464 0.714286
38 ARG LEU TYR GLN ASN PRO THR THR TYR ILE 0.433862 0.814815
39 ACE PRO LEU HIS SER TPO MET NH2 0.433526 0.8625
40 ARG PRO GLY ASN PHE LEU GLN SER ARG PRO 0.433155 0.868421
41 5PV ACE PRO LEU HIS SER TPO MET NH2 LYT 0.43299 0.875
42 ASN TRP SER HIS PRO GLN PHE GLU LYS 0.432927 0.75
43 ARG GLN ALA SEP LEU SER ILE SER VAL 0.432749 0.75
44 LYS ILE LEU HIS ARG LEU LEU GLN ASP 0.432584 0.736842
45 GLN ALA SER TPO PRO ARG NIT 0.432432 0.833333
46 ARG PRO GLY ASN PHE LEU GLN SER ARG LEU 0.432292 0.88
47 ILE SER PRO ARG THR LEU ASP ALA TRP 0.432161 0.8375
48 ALA TRP ARG HIS PRO GLN PHE GLY GLY 0.431472 0.746835
49 GLN ARG SER THR SEP THR PRO ASN VAL HIS 0.431034 0.84
50 SER ARG SEP SER PRO 0.429487 0.864865
51 ACE ASP PRO PRO LEU HIS SER TPO ALA NH2 0.429379 0.92
52 GLY LEU LEU GLY SEP PRO VAL ARG ALA 0.429379 0.893333
53 LYS PRO HIS SER ASP 0.426829 0.786667
54 GLN LEU SER PRO PHE PRO PHE ASP LEU 0.426136 0.75641
55 ARG ARG LEU PRO ILE PHE SER ARG LEU 0.425414 0.831169
56 ARG THR PHE SER PRO THR TYR GLY LEU 0.424731 0.802469
57 MET SER LEU PRO GLY ARG TRP LYS PRO LYS 0.42439 0.817073
58 LEU GLN ARG VAL LEU SEP ALA PRO PHE 0.422222 0.87013
59 TYR HIS SEP VAL VAL ARG TYR ALA 0.422222 0.8
60 ABA SER LEU TRP ASN GLY PRO HIS LEU 0.421053 0.797468
61 ARG VAL ALA SER PRO THR SER GLY VAL 0.421053 0.815789
62 ALA ASN SER ARG HIS PRO THR SER ILE ILE 0.418994 0.857143
63 GLY HIS ARG PRO 0.417722 0.773333
64 VAL GLU HIS SEP LEU ASP ASN LYS 0.414013 0.773333
65 ACE PRO LEU HIS SER TPO MET NH2 ADM 0.413978 0.833333
66 ASN ARG PRO ILE LEU SER LEU 0.411765 0.842105
67 GLU ALA ASP PRO THR GLY HIS SER TYR 0.411458 0.7625
68 LEU ASP PRO ARG 0.411392 0.773333
69 ACE LEU TYR ALA SER SER ASN PRO ALA PTR 0.409836 0.817073
70 HIS LYS ILE LEU HIS ARG LEU LEU GLN ASP 0.409836 0.727273
71 HIS SER ILE THR TYR LEU LEU PRO VAL 0.409574 0.765432
72 ARG THR PRO SEP LEU PRO GLY D4K 0.409091 0.876543
73 HIS LEU TYR PHE SER SEP ASN 0.409091 0.740741
74 ASN LYS ASN ALA ASN SEP SER PRO VAL 0.404624 0.88
75 PHE LEU PRO HIS ALY TYR ASP VAL LYS LEU 0.40404 0.695122
76 HIS SER LEU PHE HIS PUK THR PRO 0.403141 0.78481
77 ACE SER LEU ARG PRO ALA PRO LPD 0.402367 0.853333
78 GLY LEU LEU GLY SER PRO VAL ARG ALA 0.402299 0.813333
79 GLY HIS ARG PRO NH2 0.4 0.77027
Similar Ligands (3D)
Ligand no: 1; Ligand: 8OE; Similar ligands found: 317
No: Ligand Similarity coefficient
1 DCN 0.9891
2 TCL 0.9787
3 C6Z 0.9766
4 FB4 0.9688
5 J47 0.9688
6 CH8 0.9682
7 MJ5 0.9674
8 FPL 0.9654
9 4EU 0.9638
10 E9P 0.9585
11 FT2 0.9533
12 CUT 0.9514
13 TCC 0.9493
14 A8K 0.9490
15 FT3 0.9489
16 FT1 0.9482
17 HX8 0.9476
18 YUG 0.9466
19 H48 0.9431
20 S0F 0.9406
21 43F 0.9383
22 A7Q 0.9372
23 DBE 0.9370
24 CUH 0.9307
25 HXY 0.9307
26 848 0.9303
27 27M 0.9288
28 4WF 0.9288
29 7R4 0.9287
30 22F 0.9279
31 SLY 0.9261
32 N2Y 0.9251
33 C0H 0.9239
34 JA3 0.9234
35 2OH 0.9234
36 ENG 0.9233
37 D1Y 0.9228
38 PV4 0.9224
39 4FP 0.9223
40 EQW 0.9222
41 69K 0.9219
42 3IP 0.9219
43 3QO 0.9211
44 16Z 0.9201
45 M01 0.9199
46 TPM 0.9188
47 JFS 0.9187
48 W1G 0.9184
49 7VF 0.9177
50 S46 0.9171
51 LL2 0.9166
52 ERZ 0.9158
53 YIE 0.9157
54 WCU 0.9153
55 SOJ 0.9152
56 LTT 0.9146
57 C82 0.9137
58 VIB 0.9130
59 OJD 0.9121
60 11X 0.9113
61 A6H 0.9113
62 0OY 0.9110
63 A4V 0.9099
64 9JH 0.9097
65 TQL 0.9093
66 TH4 0.9081
67 9W5 0.9080
68 S1D 0.9077
69 3VW 0.9066
70 MW5 0.9065
71 TRP 0.9065
72 1KN 0.9063
73 22L 0.9062
74 9VQ 0.9059
75 G8V 0.9053
76 7ZO 0.9049
77 TOH 0.9049
78 K80 0.9048
79 5R8 0.9047
80 4NR 0.9046
81 A7K 0.9032
82 XIF XYP 0.9032
83 M02 0.9031
84 BZQ 0.9029
85 9AG 0.9026
86 FCW 0.9018
87 BPY 0.9018
88 URI 0.9016
89 JSX 0.9015
90 XYS XYS 0.9015
91 KYN 0.9012
92 LJ4 0.9003
93 KWB 0.8989
94 0OL 0.8989
95 4MP 0.8983
96 FMQ 0.8982
97 HHV 0.8981
98 1OH 0.8980
99 PW1 0.8978
100 ENO 0.8973
101 BGK 0.8972
102 DCZ 0.8969
103 6J5 0.8968
104 3TC 0.8966
105 EAT 0.8965
106 XDN XYP 0.8962
107 5NR 0.8962
108 7ZL 0.8961
109 P2L 0.8959
110 DUR 0.8957
111 2J5 0.8957
112 LTN 0.8957
113 54F 0.8956
114 KP2 0.8955
115 CUQ 0.8955
116 M2E 0.8954
117 JD7 0.8952
118 AVA 0.8952
119 VBC 0.8951
120 GNW 0.8950
121 XYP XDN 0.8946
122 FNA 0.8943
123 KUP 0.8941
124 XDL XYP 0.8939
125 0QV 0.8939
126 WL3 0.8931
127 DTR 0.8925
128 EXG 0.8925
129 9PL 0.8925
130 CC5 0.8924
131 8UY 0.8924
132 N9J 0.8920
133 XYP XIF 0.8917
134 2UB 0.8916
135 XYP XYP 0.8915
136 B5A 0.8911
137 B41 0.8910
138 GXD 0.8909
139 L5D 0.8909
140 LVP 0.8908
141 ITW 0.8902
142 AKD 0.8900
143 JPB 0.8899
144 4Z9 0.8896
145 TYR 0.8894
146 3WJ 0.8890
147 7VY 0.8884
148 AUV 0.8875
149 6SY 0.8875
150 MEX 0.8874
151 XI7 0.8874
152 PQT 0.8871
153 HMZ 0.8870
154 MMS 0.8869
155 HA6 0.8867
156 BZM 0.8864
157 B4O 0.8863
158 CW6 0.8863
159 9W7 0.8862
160 AYS 0.8862
161 DFL 0.8860
162 CFA 0.8859
163 JF5 0.8859
164 TZM 0.8858
165 1BN 0.8858
166 3IL 0.8858
167 AX4 0.8857
168 C4F 0.8857
169 C0W 0.8854
170 TI7 0.8853
171 6J9 0.8851
172 WVV 0.8851
173 5E4 0.8847
174 BIE 0.8845
175 AJD 0.8841
176 YIP 0.8835
177 CBE 0.8834
178 2JX 0.8830
179 THM 0.8829
180 QTV 0.8829
181 OA1 0.8829
182 RVE 0.8825
183 BDJ 0.8825
184 HO6 0.8825
185 CC7 0.8821
186 50Q 0.8818
187 12R 0.8817
188 0D1 0.8815
189 NAL 0.8814
190 6C5 0.8809
191 78U 0.8805
192 5TO 0.8800
193 2L1 0.8797
194 F63 0.8797
195 4K2 0.8796
196 X6P 0.8796
197 H7S 0.8793
198 PYU 0.8788
199 5DE 0.8788
200 DAH 0.8788
201 4L2 0.8787
202 AZY 0.8784
203 92O 0.8782
204 HLP 0.8781
205 EMU 0.8778
206 Q8G 0.8775
207 DBS 0.8775
208 Q8D 0.8773
209 M5E 0.8771
210 FCD 0.8768
211 ELH 0.8767
212 6WS 0.8766
213 DFV 0.8765
214 96Z 0.8761
215 2B4 0.8757
216 KHP 0.8756
217 3DE 0.8756
218 4BF 0.8751
219 977 0.8750
220 2GA 0.8749
221 6J3 0.8748
222 Q2S 0.8748
223 0OO 0.8747
224 1YO 0.8743
225 M6H 0.8741
226 BXZ 0.8739
227 DTY 0.8739
228 MP5 0.8737
229 PFF 0.8734
230 H35 0.8733
231 LOX XYP 0.8729
232 EV2 0.8729
233 9F8 0.8726
234 PFT 0.8726
235 ZEA 0.8726
236 SV4 0.8722
237 PIR 0.8720
238 CTN 0.8715
239 XIL 0.8714
240 92G 0.8712
241 DHC 0.8711
242 LVY 0.8709
243 CHV 0.8709
244 BP3 0.8706
245 ADN 0.8705
246 5AD 0.8703
247 LLT 0.8699
248 PPY 0.8696
249 C93 0.8695
250 SBK 0.8695
251 JE7 0.8693
252 2LT 0.8690
253 FUZ 0.8689
254 S0G 0.8684
255 CHQ 0.8684
256 IAG 0.8684
257 CMU 0.8683
258 IOP 0.8681
259 X29 0.8681
260 VJP 0.8680
261 56D 0.8678
262 TYP 0.8678
263 6DE 0.8676
264 QTD 0.8675
265 G14 0.8674
266 LP8 0.8673
267 0K7 0.8671
268 AED 0.8670
269 MUX 0.8666
270 XYP XYS 0.8664
271 EQA 0.8664
272 U4J 0.8664
273 BZS 0.8664
274 RQD 0.8664
275 5AE 0.8663
276 TOM 0.8661
277 1HR 0.8660
278 I2E 0.8658
279 CTE 0.8651
280 YOF 0.8650
281 1U7 0.8647
282 QC1 0.8646
283 Q4G 0.8643
284 AGI 0.8641
285 PLP 0.8640
286 36M 0.8639
287 HWD 0.8630
288 I5A 0.8624
289 67Y 0.8619
290 FHI 0.8619
291 XDK 0.8617
292 D4G 0.8612
293 3B4 0.8612
294 QTJ 0.8607
295 5R9 0.8607
296 6HO 0.8601
297 EF2 0.8601
298 MZR 0.8600
299 5I5 0.8596
300 HNL 0.8596
301 IWH 0.8595
302 JPQ 0.8590
303 KF5 0.8590
304 LLG 0.8586
305 CDY 0.8583
306 HJH 0.8583
307 B4L 0.8582
308 LI4 0.8580
309 9FH 0.8577
310 0QW 0.8571
311 TYC 0.8556
312 2UD 0.8545
313 5WS 0.8540
314 TCT 0.8525
315 LVD 0.8524
316 68B 0.8522
317 50C 0.8522
Ligand no: 2; Ligand: ARG SER HIS SEP SER PRO ALA SER LEU GLN; 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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