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- Structure Biounit | Ligand Information
- PDB : .ZIP | .CSV
- Family 90% : .ZIP | .CSV
- Class : .ZIP | .CSV
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 19 families. | |||||
1 | 1YPE | Ki = 8 nM | UIP | C26 H30 N4 O3 | CC[C@@H]1[.... |
2 | 1YPM | Ki = 1.9 uM | RA4 | C23 H35 N7 O5 | [H]/N=C(N).... |
3 | 1YPJ | Ki = 95 nM | UIB | C26 H32 N4 O3 | CC[C@@H]1[.... |
4 | 1YPG | Ki = 10 nM | UIR | C27 H30 N4 O3 | c1cc(ccc1[.... |
5 | 1H8D | - | PHW | C45 H48 N3 O9 P | CO/C=C/C[C.... |
6 | 1H8I | - | ASP PHE GLU GLU ILE PRO GLU GLU TYS LEU | n/a | n/a |
7 | 1YPL | Ki = 10.6 uM | RA8 | C23 H38 N6 O4 S | [H]/N=C(/N.... |
8 | 3U8T | Ki = 16.5 uM | DPN PRO DAR CYS NH2 | n/a | n/a |
9 | 1EB1 | Ki = 37 pM | ZAL PRO MMO | n/a | n/a |
10 | 1YPK | - | CCR | C29 H39 N5 O7 S | Cc1cc(c(c(.... |
11 | 1SB1 | Ki = 128 nM | 165 | C28 H35 N5 O4 S2 | c1ccc(cc1).... |
12 | 4LOY | - | ASP PHE GLU GLU ILE PRO GLU GLU TYS LEU | n/a | n/a |
13 | 4HFP | Kd = 42 nM | 15U | C23 H36 N6 O5 S | [H]/N=C(N).... |
14 | 1TWX | - | ASP PHE GLU GLU ILE PRO GLY GLU TYS LEU | n/a | n/a |
15 | 1VR1 | - | ASP PHE GLU GLU ILE PRO GLU GLU TYS LEU | n/a | n/a |
16 | 3BV9 | Ki = 4.4 uM | DAR OIC PRO DAL 4PH NH2 | n/a | n/a |
17 | 3U8R | Ki = 7.7 uM | DPN PRO DAR ILE NH2 | n/a | n/a |
18 | 3U8O | Ki = 0.92 uM | DPN PRO DAR DTH NH2 | n/a | n/a |
19 | 1ETR | - | MIT | C23 H37 N6 O5 S | C[C@@H]1CC.... |
20 | 1ETS | Ki = 6 nM | MID | C27 H31 N5 O4 S | [H]/N=C(/c.... |
21 | 1HXF | - | ASP PHE GLU GLU ILE PRO GLY GLU TYR LEU | n/a | n/a |
22 | 1C5N | Ki = 20 uM | ESI | C9 H8 I N2 S | c1cc2c(cc(.... |
23 | 2JH0 | Ki = 2 nM | 701 | C18 H24 Cl N3 O5 S2 | C[C@@H](C(.... |
24 | 1WBG | ic50 = 1 mM | L03 | C9 H8 Cl N3 S | CSc1[nH]c(.... |
25 | 1AFE | - | ASP PHE GLU GLU ILE PRO GLU GLU TYS LEU | n/a | n/a |
26 | 3DA9 | Kd = 3.1 uM | 44U | C23 H29 N3 O2 | CCCNC(=O)[.... |
27 | 2UUJ | - | ASP PHE GLU GLU ILE PRO GLU GLU TYS LEU | n/a | n/a |
28 | 1QHR | - | ASP PHE GLU GLU ILE PRO GLU GLU TYS LEU | n/a | n/a |
29 | 1QJ1 | ic50 = 9 nM | ASP PHE GLU GLU ILE PRO GLU GLU TYS LEU | n/a | n/a |
30 | 1AE8 | - | AZL | C21 H33 N5 O4 | CCOC(=O)N[.... |
31 | 1C5L | - | ASP PHE GLU GLU ILE PRO GLU GLU TYS LEU | n/a | n/a |
32 | 4BAO | Ki = 4.29 nM | MVF | C22 H32 N6 O3 | [H]/N=C(/c.... |
33 | 2JH5 | Ki = 367 nM | 895 | C17 H22 Cl N3 O5 S2 | C[C@@H](C(.... |
34 | 1HXE | - | ASP PHE GLU GLU ILE PRO GLY GLU TYR LEU | n/a | n/a |
35 | 1QJ6 | ic50 = 18 nM | ASP PHE GLU GLU ILE PRO GLU GLU TYS LEU | n/a | n/a |
36 | 1AWF | Ki = 0.97 uM | ASP PHE GLU GLU ILE PRO GLU GLU TYS LEU | n/a | n/a |
37 | 2GDE | ic50 = 5.7 nM | SN3 | C26 H43 Cl N6 O10 S | [H]/N=C(N).... |
38 | 8KME | Ki = 8 uM | ACE 0BN CHG MLY LEU PRO NH2 | n/a | n/a |
39 | 1NY2 | - | ASP PHE GLU GLU ILE PRO GLU GLU TYS LEU | n/a | n/a |
40 | 2H9T | - | SVR | C51 H40 N6 O23 S6 | Cc1ccc(cc1.... |
41 | 1QJ7 | ic50 = 18 nM | ASP PHE GLU GLU ILE PRO GLU GLU TYS LEU | n/a | n/a |
42 | 1UMA | - | IN2 | C8 H18 N4 O3 | CN(C)C(=O).... |
43 | 2UUK | - | ASP PHE GLU GLU ILE PRO GLU GLU TYS LEU | n/a | n/a |
44 | 1AD8 | Ki = 247 nM | ASP PHE GLU GLU ILE PRO GLU GLU TYS LEU | n/a | n/a |
45 | 2UUF | - | ASP PHE GLU GLU ILE PRO GLU GLU TYS LEU | n/a | n/a |
46 | 1XMN | - | SGN IDS SGN IDS SGN | n/a | n/a |
47 | 2JH6 | Ki = 17 nM | 894 | C17 H24 Cl N3 O5 S2 | C[C@@H](C(.... |
48 | 2ANM | ic50 = 1.8 nM | CDO | C23 H32 N6 O4 | [H]/N=C(/c.... |
49 | 1HAH | - | ASP PHE GLU GLU ILE PRO GLU GLU TYS LEU | n/a | n/a |
50 | 3BF6 | ic50 = 40 uM | SVR | C51 H40 N6 O23 S6 | Cc1ccc(cc1.... |
51 | 1WAY | ic50 = 400 uM | L02 | C14 H16 Cl N3 | c1cc(ccc1c.... |
52 | 7KME | Ki = 40 uM | ASP PHE GLU GLU ILE PRO GLU GLU TYS LEU | n/a | n/a |
53 | 3PMA | - | GU4 YYJ | n/a | n/a |
54 | 3BEF | - | ASN ASP LYS TYR GLU PRO PHE TRP GLU | n/a | n/a |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 16 families. | |||||
1 | 1YPE | Ki = 8 nM | UIP | C26 H30 N4 O3 | CC[C@@H]1[.... |
2 | 1YPM | Ki = 1.9 uM | RA4 | C23 H35 N7 O5 | [H]/N=C(N).... |
3 | 1YPJ | Ki = 95 nM | UIB | C26 H32 N4 O3 | CC[C@@H]1[.... |
4 | 1YPG | Ki = 10 nM | UIR | C27 H30 N4 O3 | c1cc(ccc1[.... |
5 | 1H8D | - | PHW | C45 H48 N3 O9 P | CO/C=C/C[C.... |
6 | 1H8I | - | ASP PHE GLU GLU ILE PRO GLU GLU TYS LEU | n/a | n/a |
7 | 1YPL | Ki = 10.6 uM | RA8 | C23 H38 N6 O4 S | [H]/N=C(/N.... |
8 | 3U8T | Ki = 16.5 uM | DPN PRO DAR CYS NH2 | n/a | n/a |
9 | 1EB1 | Ki = 37 pM | ZAL PRO MMO | n/a | n/a |
10 | 1YPK | - | CCR | C29 H39 N5 O7 S | Cc1cc(c(c(.... |
11 | 1SB1 | Ki = 128 nM | 165 | C28 H35 N5 O4 S2 | c1ccc(cc1).... |
12 | 4LOY | - | ASP PHE GLU GLU ILE PRO GLU GLU TYS LEU | n/a | n/a |
13 | 4HFP | Kd = 42 nM | 15U | C23 H36 N6 O5 S | [H]/N=C(N).... |
14 | 1TWX | - | ASP PHE GLU GLU ILE PRO GLY GLU TYS LEU | n/a | n/a |
15 | 1VR1 | - | ASP PHE GLU GLU ILE PRO GLU GLU TYS LEU | n/a | n/a |
16 | 3BV9 | Ki = 4.4 uM | DAR OIC PRO DAL 4PH NH2 | n/a | n/a |
17 | 3U8R | Ki = 7.7 uM | DPN PRO DAR ILE NH2 | n/a | n/a |
18 | 3U8O | Ki = 0.92 uM | DPN PRO DAR DTH NH2 | n/a | n/a |
19 | 1UVT | Ki = 0.023 uM | I48 | C20 H22 N3 O3 S | Cc1cc(cc(c.... |
20 | 1ETT | Ki = 1.3 uM | 4QQ | C22 H28 N4 O3 S | [H]/N=C(c1.... |
21 | 1ETR | - | MIT | C23 H37 N6 O5 S | C[C@@H]1CC.... |
22 | 1ETS | Ki = 6 nM | MID | C27 H31 N5 O4 S | [H]/N=C(/c.... |
23 | 1HXF | - | ASP PHE GLU GLU ILE PRO GLY GLU TYR LEU | n/a | n/a |
24 | 1C5N | Ki = 20 uM | ESI | C9 H8 I N2 S | c1cc2c(cc(.... |
25 | 2JH0 | Ki = 2 nM | 701 | C18 H24 Cl N3 O5 S2 | C[C@@H](C(.... |
26 | 1WBG | ic50 = 1 mM | L03 | C9 H8 Cl N3 S | CSc1[nH]c(.... |
27 | 1AFE | - | ASP PHE GLU GLU ILE PRO GLU GLU TYS LEU | n/a | n/a |
28 | 3DA9 | Kd = 3.1 uM | 44U | C23 H29 N3 O2 | CCCNC(=O)[.... |
29 | 2UUJ | - | ASP PHE GLU GLU ILE PRO GLU GLU TYS LEU | n/a | n/a |
30 | 1QHR | - | ASP PHE GLU GLU ILE PRO GLU GLU TYS LEU | n/a | n/a |
31 | 1QJ1 | ic50 = 9 nM | ASP PHE GLU GLU ILE PRO GLU GLU TYS LEU | n/a | n/a |
32 | 1AE8 | - | AZL | C21 H33 N5 O4 | CCOC(=O)N[.... |
33 | 1C5L | - | ASP PHE GLU GLU ILE PRO GLU GLU TYS LEU | n/a | n/a |
34 | 4BAO | Ki = 4.29 nM | MVF | C22 H32 N6 O3 | [H]/N=C(/c.... |
35 | 2JH5 | Ki = 367 nM | 895 | C17 H22 Cl N3 O5 S2 | C[C@@H](C(.... |
36 | 1HXE | - | ASP PHE GLU GLU ILE PRO GLY GLU TYR LEU | n/a | n/a |
37 | 1QJ6 | ic50 = 18 nM | ASP PHE GLU GLU ILE PRO GLU GLU TYS LEU | n/a | n/a |
38 | 1AWF | Ki = 0.97 uM | ASP PHE GLU GLU ILE PRO GLU GLU TYS LEU | n/a | n/a |
39 | 2GDE | ic50 = 5.7 nM | SN3 | C26 H43 Cl N6 O10 S | [H]/N=C(N).... |
40 | 8KME | Ki = 8 uM | ACE 0BN CHG MLY LEU PRO NH2 | n/a | n/a |
41 | 1NY2 | - | ASP PHE GLU GLU ILE PRO GLU GLU TYS LEU | n/a | n/a |
42 | 2H9T | - | SVR | C51 H40 N6 O23 S6 | Cc1ccc(cc1.... |
43 | 1QJ7 | ic50 = 18 nM | ASP PHE GLU GLU ILE PRO GLU GLU TYS LEU | n/a | n/a |
44 | 1UMA | - | IN2 | C8 H18 N4 O3 | CN(C)C(=O).... |
45 | 2UUK | - | ASP PHE GLU GLU ILE PRO GLU GLU TYS LEU | n/a | n/a |
46 | 1AD8 | Ki = 247 nM | ASP PHE GLU GLU ILE PRO GLU GLU TYS LEU | n/a | n/a |
47 | 2UUF | - | ASP PHE GLU GLU ILE PRO GLU GLU TYS LEU | n/a | n/a |
48 | 1XMN | - | SGN IDS SGN IDS SGN | n/a | n/a |
49 | 2JH6 | Ki = 17 nM | 894 | C17 H24 Cl N3 O5 S2 | C[C@@H](C(.... |
50 | 2ANM | ic50 = 1.8 nM | CDO | C23 H32 N6 O4 | [H]/N=C(/c.... |
51 | 1HAH | - | ASP PHE GLU GLU ILE PRO GLU GLU TYS LEU | n/a | n/a |
52 | 3BF6 | ic50 = 40 uM | SVR | C51 H40 N6 O23 S6 | Cc1ccc(cc1.... |
53 | 1WAY | ic50 = 400 uM | L02 | C14 H16 Cl N3 | c1cc(ccc1c.... |
54 | 7KME | Ki = 40 uM | ASP PHE GLU GLU ILE PRO GLU GLU TYS LEU | n/a | n/a |
55 | 3PMA | - | GU4 YYJ | n/a | n/a |
56 | 3BEF | - | ASN ASP LYS TYR GLU PRO PHE TRP GLU | n/a | n/a |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | J3I | 0.8822 |
No: | Ligand | Similarity coefficient |
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