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- Class : .ZIP | .CSV
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 15 families. | |||||
1 | 3OLE | Ki = 0.0147 uM | GLC GLC G6D GLC ACI G6D ACI | n/a | n/a |
2 | 5EMY | - | 5QP | C13 H24 O10 | C1[C@H]([C.... |
3 | 1XD0 | Ki = 0.075 uM | ARE | C31 H53 N O23 | C[C@@H]1[C.... |
4 | 1U2Y | Ki = 18 mM | GOX | C6 H12 N2 O5 | C([C@@H]1[.... |
5 | 3OLD | Ki = 1.2549 uM | GLC GLC G6D GLC ACI GLC | n/a | n/a |
6 | 1XH0 | - | AAO | C37 H63 N O28 | C[C@@H]1[C.... |
7 | 1XD1 | Ki = 0.012 uM | 6SA | C37 H63 N O28 | C[C@@H]1[C.... |
8 | 3CPU | - | GLC GLC | n/a | n/a |
9 | 1U33 | Ki = 25 uM | LM2 | C19 H34 N2 O15 | CO[C@@H]1[.... |
10 | 1XH2 | - | ARE | C31 H53 N O23 | C[C@@H]1[C.... |
11 | 3OLG | Ki = 0.0143 uM | BGC GLC G6D GLC HSD G6D HSD | n/a | n/a |
12 | 3BAY | - | ARE | C31 H53 N O23 | C[C@@H]1[C.... |
13 | 1Z32 | - | AGL GLC HMC | n/a | n/a |
14 | 3DHP | - | GLC GLC AGL HMC | n/a | n/a |
15 | 3IJ7 | - | GLF B8D | n/a | n/a |
16 | 5TD4 | - | GLC GLC GLC GLC GLC GLC | n/a | n/a |
17 | 3OLI | Ki = 0.0416 uM | GLC GLC G6D GLC HSD G6D HSD | n/a | n/a |
18 | 1U30 | Ki = 1.8 mM | GOX | C6 H12 N2 O5 | C([C@@H]1[.... |
19 | 1XCX | - | BGC GLC AC1 | n/a | n/a |
20 | 4W93 | Ki = 8 nM | 3L9 | C53 H64 O33 | C[C@H]1[C@.... |
21 | 1CPU | - | GLC GLC AGL HMC GLC | n/a | n/a |
22 | 1XCW | - | GLC AC1 | n/a | n/a |
23 | 2QV4 | - | QV4 | C31 H53 N O23 | C[C@@H]1[C.... |
24 | 3IJ9 | - | B0D | C6 H10 F2 O5 | C([C@]1([C.... |
25 | 6OCN | - | NAG | C8 H15 N O6 | CC(=O)N[C@.... |
26 | 3IJ8 | - | B0D | C6 H10 F2 O5 | C([C@]1([C.... |
27 | 6OBX | - | ZXU | C36 H32 N2 O12 | c1cc(ccc1C.... |
28 | 1NM9 | - | GLC AGL HMC | n/a | n/a |
29 | 4GQQ | - | 0XR | C11 H12 O4 | CCOC(=O)/C.... |
30 | 3BAJ | - | ARE | C31 H53 N O23 | C[C@@H]1[C.... |
31 | 4GQR | Ki = 110 uM | MYC | C15 H10 O8 | c1c(cc(c(c.... |
32 | 1OSE | - | BGC AC1 GLC AC1 | n/a | n/a |
33 | 3L2M | - | GLC GLC GLC GLC GLC GLC | n/a | n/a |
34 | 1HX0 | - | GLC AC1 GLC AC1 | n/a | n/a |
35 | 1WO2 | - | BGC GLC GLC | n/a | n/a |
36 | 1JFH | Ki = 9 mM | MA3 MA2 | n/a | n/a |
37 | 3L2L | - | GLC GLC GLC GLC | n/a | n/a |
38 | 1UA3 | - | GLC GLC GLC | n/a | n/a |
39 | 1VAH | - | NPO | C6 H5 N O3 | c1cc(ccc1[.... |
40 | 1PPI | Ki = 9.7 uM | BGC GLC DAF GLC | n/a | n/a |
41 | 1PIG | ic50 = 0.7 nM | BGC GLC AGL GLC HMC AGL | n/a | n/a |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 12 families. | |||||
1 | 3OLE | Ki = 0.0147 uM | GLC GLC G6D GLC ACI G6D ACI | n/a | n/a |
2 | 5EMY | - | 5QP | C13 H24 O10 | C1[C@H]([C.... |
3 | 1XD0 | Ki = 0.075 uM | ARE | C31 H53 N O23 | C[C@@H]1[C.... |
4 | 1U2Y | Ki = 18 mM | GOX | C6 H12 N2 O5 | C([C@@H]1[.... |
5 | 3OLD | Ki = 1.2549 uM | GLC GLC G6D GLC ACI GLC | n/a | n/a |
6 | 1XH0 | - | AAO | C37 H63 N O28 | C[C@@H]1[C.... |
7 | 1XD1 | Ki = 0.012 uM | 6SA | C37 H63 N O28 | C[C@@H]1[C.... |
8 | 3CPU | - | GLC GLC | n/a | n/a |
9 | 1U33 | Ki = 25 uM | LM2 | C19 H34 N2 O15 | CO[C@@H]1[.... |
10 | 1XH2 | - | ARE | C31 H53 N O23 | C[C@@H]1[C.... |
11 | 3OLG | Ki = 0.0143 uM | BGC GLC G6D GLC HSD G6D HSD | n/a | n/a |
12 | 3BAY | - | ARE | C31 H53 N O23 | C[C@@H]1[C.... |
13 | 1Z32 | - | AGL GLC HMC | n/a | n/a |
14 | 3DHP | - | GLC GLC AGL HMC | n/a | n/a |
15 | 3IJ7 | - | GLF B8D | n/a | n/a |
16 | 5TD4 | - | GLC GLC GLC GLC GLC GLC | n/a | n/a |
17 | 3OLI | Ki = 0.0416 uM | GLC GLC G6D GLC HSD G6D HSD | n/a | n/a |
18 | 1U30 | Ki = 1.8 mM | GOX | C6 H12 N2 O5 | C([C@@H]1[.... |
19 | 1XCX | - | BGC GLC AC1 | n/a | n/a |
20 | 4W93 | Ki = 8 nM | 3L9 | C53 H64 O33 | C[C@H]1[C@.... |
21 | 1CPU | - | GLC GLC AGL HMC GLC | n/a | n/a |
22 | 1XCW | - | GLC AC1 | n/a | n/a |
23 | 2QV4 | - | QV4 | C31 H53 N O23 | C[C@@H]1[C.... |
24 | 3IJ9 | - | B0D | C6 H10 F2 O5 | C([C@]1([C.... |
25 | 6OCN | - | NAG | C8 H15 N O6 | CC(=O)N[C@.... |
26 | 3IJ8 | - | B0D | C6 H10 F2 O5 | C([C@]1([C.... |
27 | 6OBX | - | ZXU | C36 H32 N2 O12 | c1cc(ccc1C.... |
28 | 1NM9 | - | GLC AGL HMC | n/a | n/a |
29 | 4GQQ | - | 0XR | C11 H12 O4 | CCOC(=O)/C.... |
30 | 3BAJ | - | ARE | C31 H53 N O23 | C[C@@H]1[C.... |
31 | 4GQR | Ki = 110 uM | MYC | C15 H10 O8 | c1c(cc(c(c.... |
32 | 6M4M | - | GLC GLC GLC GLC GLC GLC | n/a | n/a |
33 | 1OSE | - | BGC AC1 GLC AC1 | n/a | n/a |
34 | 3L2M | - | GLC GLC GLC GLC GLC GLC | n/a | n/a |
35 | 1HX0 | - | GLC AC1 GLC AC1 | n/a | n/a |
36 | 1WO2 | - | BGC GLC GLC | n/a | n/a |
37 | 1JFH | Ki = 9 mM | MA3 MA2 | n/a | n/a |
38 | 3L2L | - | GLC GLC GLC GLC | n/a | n/a |
39 | 1UA3 | - | GLC GLC GLC | n/a | n/a |
40 | 1VAH | - | NPO | C6 H5 N O3 | c1cc(ccc1[.... |
41 | 1PPI | Ki = 9.7 uM | BGC GLC DAF GLC | n/a | n/a |
42 | 1PIG | ic50 = 0.7 nM | BGC GLC AGL GLC HMC AGL | n/a | n/a |
43 | 1G94 | - | GLC GLC GLC DAF DAF | n/a | n/a |
44 | 1KXH | - | GLC GLC AC1 | n/a | n/a |
45 | 1G9H | - | BGC DAF | n/a | n/a |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | 5QP | 1 | 1 |
2 | BQZ | 0.519231 | 0.909091 |
3 | RR7 GLC | 0.517241 | 0.888889 |
4 | BGC GLA GAL | 0.5 | 0.885714 |
5 | 9MR | 0.491803 | 0.744186 |
6 | IFM BGC | 0.491803 | 0.711111 |
7 | GAL GLA | 0.491228 | 0.885714 |
8 | MAN BMA BMA | 0.484375 | 0.942857 |
9 | NOJ GLC | 0.483871 | 0.733333 |
10 | ABL | 0.47619 | 0.666667 |
11 | MGL GAL | 0.474576 | 0.837838 |
12 | MBG GLA | 0.473684 | 0.837838 |
13 | BGC OXZ | 0.467742 | 0.666667 |
14 | GLC EDO GLC | 0.467742 | 0.888889 |
15 | GLC DMJ | 0.460317 | 0.733333 |
16 | BGC BGC BGC BGC BGC BGC BGC BGC BGC | 0.459016 | 0.885714 |
17 | MAN BMA BMA BMA BMA BMA BMA | 0.459016 | 0.885714 |
18 | GLC GLC GLC GLC BGC GLC GLC | 0.459016 | 0.885714 |
19 | CJX | 0.453125 | 0.680851 |
20 | BGC BGC BGC BGC BGC BGC | 0.451613 | 0.885714 |
21 | BGC BGC BGC BGC BGC | 0.451613 | 0.885714 |
22 | GLC BGC BGC BGC | 0.451613 | 0.885714 |
23 | BGC BGC BGC | 0.451613 | 0.885714 |
24 | BGC BGC BGC BGC BGC BGC BGC | 0.451613 | 0.885714 |
25 | RZM | 0.45 | 0.688889 |
26 | MBG GAL | 0.45 | 0.837838 |
27 | G3I | 0.449275 | 0.727273 |
28 | G2I | 0.449275 | 0.727273 |
29 | GDQ GLC | 0.446154 | 0.666667 |
30 | 7D1 MAN | 0.442623 | 0.888889 |
31 | NOY BGC | 0.4375 | 0.632653 |
32 | MAN MNM | 0.4375 | 0.632653 |
33 | FUC GAL | 0.435484 | 0.833333 |
34 | MAN MAN | 0.433333 | 0.941176 |
35 | BGC XGP | 0.430769 | 0.704545 |
36 | GCU BGC | 0.430769 | 0.810811 |
37 | BGC OXZ BGC | 0.428571 | 0.653061 |
38 | MAN IPD MAN | 0.428571 | 0.704545 |
39 | FRU BMA | 0.428571 | 0.794872 |
40 | MAN GLA ABE | 0.424658 | 0.864865 |
41 | MMA GLA ABE | 0.424658 | 0.820513 |
42 | BGC GAL GLA | 0.424242 | 0.885714 |
43 | GPM GLC | 0.424242 | 0.688889 |
44 | MAN G63 | 0.424242 | 0.6875 |
45 | ISX | 0.421875 | 0.72093 |
46 | IPD MAN | 0.421875 | 0.697674 |
47 | MAN MAN BMA | 0.42029 | 0.942857 |
48 | G2F BGC BGC BGC BGC BGC | 0.42029 | 0.820513 |
49 | GLC G6P | 0.419355 | 0.704545 |
50 | AHR FUB | 0.418182 | 0.756757 |
51 | BDF GLC | 0.41791 | 0.916667 |
52 | BGC 5VQ GAL GLA | 0.41791 | 0.794872 |
53 | G2F SHG BGC BGC | 0.41791 | 0.794872 |
54 | XYS GLC GLC | 0.416667 | 0.861111 |
55 | GLC IFM | 0.415385 | 0.688889 |
56 | BMA MAN MAN | 0.411765 | 0.885714 |
57 | LG9 GLC | 0.411765 | 0.603774 |
58 | GLC U8V | 0.40625 | 0.815789 |
59 | FRU GLC | 0.40625 | 0.794872 |
60 | DGO MAN | 0.40625 | 0.861111 |
61 | H1M MAN MAN | 0.405405 | 0.820513 |
62 | GLC GLC GLC | 0.402778 | 0.942857 |
63 | CK0 | 0.402778 | 0.680851 |
64 | GLC NBU GAL GLA | 0.4 | 0.756098 |
65 | BGC BGC BGC BGC BGC BGC BGC BGC | 0.4 | 0.885714 |
66 | GLC BGC FUC GAL | 0.4 | 0.861111 |
67 | BGC FUC GAL | 0.4 | 0.861111 |
68 | NAG BMA | 0.4 | 0.6875 |
No: | Ligand | Similarity coefficient |
---|
This union binding pocket(no: 1) in the query (biounit: 4w93.bio1) has 33 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |