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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 426 families. | |||||
1 | 5MAY | Kd = 0.29 uM | FUL PK6 | n/a | n/a |
2 | 5MB1 | Kd = 0.000000064 M | FUL 7KT | n/a | n/a |
3 | 4UT5 | - | GAL NAG GAL FUC | n/a | n/a |
4 | 1OVS | - | MAN MAN | n/a | n/a |
5 | 2JDU | Kd = 0.19 uM | MFU | C7 H14 O5 | C[C@H]1[C@.... |
6 | 2JDM | Kd = 3.96 uM | MFU | C7 H14 O5 | C[C@H]1[C@.... |
7 | 6Q77 | - | DLE DLY DAL DLE DLY DLY DLE DAL ZDC | n/a | n/a |
8 | 2JDH | Kd = 310 nM | NAG TA5 FUC | n/a | n/a |
9 | 5A3O | Kd = 18.5 uM | MMA DH6 | n/a | n/a |
10 | 1OXC | - | FUC | C6 H12 O5 | C[C@H]1[C@.... |
11 | 3ZDV | Kd = 3.3 uM | MMA F1A | n/a | n/a |
12 | 2JDP | Kd = 0.25 uM | MFU | C7 H14 O5 | C[C@H]1[C@.... |
13 | 1W8H | Ka = 47000000000 M^-1 | NDG GAL FUC | n/a | n/a |
14 | 1UZV | Kd = 0.6667 uM | FUC | C6 H12 O5 | C[C@H]1[C@.... |
15 | 2BP6 | - | GXL | C6 H12 O6 | C([C@H]1[C.... |
16 | 6R35 | - | NAG FUC GAL | n/a | n/a |
17 | 2JDY | Kd = 42.9 uM | MMA | C7 H14 O6 | CO[C@@H]1[.... |
18 | 3DCQ | ic50 = 5.94 uM | 2G0 | C25 H45 N5 O8 | C[C@H]1[C@.... |
19 | 1W8F | Ka = 15600000000 M^-1 | BGC FUC GAL NAG | n/a | n/a |
20 | 1OUR | - | MAN | C6 H12 O6 | C([C@@H]1[.... |
21 | 2JDK | Kd = 0.000000064 M | NAG T45 FUC | n/a | n/a |
22 | 2VUC | - | FUC | C6 H12 O5 | C[C@H]1[C@.... |
23 | 6S5P | - | LYS ALA ALA LYS ALA CYS NH2 ZDC | n/a | n/a |
24 | 2BOJ | Kd = 1.7 uM | ARW | C6 H12 O5 | CO[C@H]1[C.... |
25 | 1OVP | - | BDF | C6 H12 O6 | C1[C@H]([C.... |
26 | 1GZT | ic50 = 0.25 mM | FUC | C6 H12 O5 | C[C@H]1[C@.... |
27 | 2JDN | Kd = 2.78 uM | MMA | C7 H14 O6 | CO[C@@H]1[.... |
28 | 2BV4 | ic50 = 600 uM | MMA | C7 H14 O6 | CO[C@@H]1[.... |
29 | 2BOI | ic50 = 48 uM | MFU | C7 H14 O5 | C[C@H]1[C@.... |
30 | 1UQX | - | MMA | C7 H14 O6 | CO[C@@H]1[.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 322 families. | |||||
1 | 5MAY | Kd = 0.29 uM | FUL PK6 | n/a | n/a |
2 | 5MB1 | Kd = 0.000000064 M | FUL 7KT | n/a | n/a |
3 | 4UT5 | - | GAL NAG GAL FUC | n/a | n/a |
4 | 1OVS | - | MAN MAN | n/a | n/a |
5 | 2JDU | Kd = 0.19 uM | MFU | C7 H14 O5 | C[C@H]1[C@.... |
6 | 2JDM | Kd = 3.96 uM | MFU | C7 H14 O5 | C[C@H]1[C@.... |
7 | 6Q77 | - | DLE DLY DAL DLE DLY DLY DLE DAL ZDC | n/a | n/a |
8 | 2JDH | Kd = 310 nM | NAG TA5 FUC | n/a | n/a |
9 | 5A3O | Kd = 18.5 uM | MMA DH6 | n/a | n/a |
10 | 1OXC | - | FUC | C6 H12 O5 | C[C@H]1[C@.... |
11 | 3ZDV | Kd = 3.3 uM | MMA F1A | n/a | n/a |
12 | 2JDP | Kd = 0.25 uM | MFU | C7 H14 O5 | C[C@H]1[C@.... |
13 | 1W8H | Ka = 47000000000 M^-1 | NDG GAL FUC | n/a | n/a |
14 | 1UZV | Kd = 0.6667 uM | FUC | C6 H12 O5 | C[C@H]1[C@.... |
15 | 2BP6 | - | GXL | C6 H12 O6 | C([C@H]1[C.... |
16 | 6R35 | - | NAG FUC GAL | n/a | n/a |
17 | 2JDY | Kd = 42.9 uM | MMA | C7 H14 O6 | CO[C@@H]1[.... |
18 | 3DCQ | ic50 = 5.94 uM | 2G0 | C25 H45 N5 O8 | C[C@H]1[C@.... |
19 | 1W8F | Ka = 15600000000 M^-1 | BGC FUC GAL NAG | n/a | n/a |
20 | 1OUR | - | MAN | C6 H12 O6 | C([C@@H]1[.... |
21 | 2JDK | Kd = 0.000000064 M | NAG T45 FUC | n/a | n/a |
22 | 2VUC | - | FUC | C6 H12 O5 | C[C@H]1[C@.... |
23 | 6S5P | - | LYS ALA ALA LYS ALA CYS NH2 ZDC | n/a | n/a |
24 | 2BOJ | Kd = 1.7 uM | ARW | C6 H12 O5 | CO[C@H]1[C.... |
25 | 1OVP | - | BDF | C6 H12 O6 | C1[C@H]([C.... |
26 | 1GZT | ic50 = 0.25 mM | FUC | C6 H12 O5 | C[C@H]1[C@.... |
27 | 2JDN | Kd = 2.78 uM | MMA | C7 H14 O6 | CO[C@@H]1[.... |
28 | 2BV4 | ic50 = 600 uM | MMA | C7 H14 O6 | CO[C@@H]1[.... |
29 | 2BOI | ic50 = 48 uM | MFU | C7 H14 O5 | C[C@H]1[C@.... |
30 | 1UQX | - | MMA | C7 H14 O6 | CO[C@@H]1[.... |
31 | 2WR9 | Kd = 2.6 uM | MAN MAN | n/a | n/a |
32 | 2VNV | Kd = 2.75 uM | MMA | C7 H14 O6 | CO[C@@H]1[.... |
33 | 2WRA | Kd = 26.9 uM | MAN MAN MAN | n/a | n/a |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | MAN MAN | 1 | 1 |
2 | GAL FUC | 0.686275 | 0.970588 |
3 | 7D1 MAN | 0.584906 | 0.942857 |
4 | GLC IFM | 0.571429 | 0.727273 |
5 | BQZ | 0.5 | 0.909091 |
6 | ISX | 0.5 | 0.761905 |
7 | GAL GLA | 0.5 | 0.941176 |
8 | XYP IOB BGC | 0.486111 | 0.780488 |
9 | 3CU GLC | 0.483333 | 0.615385 |
10 | RZM | 0.482143 | 0.688889 |
11 | MBG GLA | 0.481481 | 0.888889 |
12 | MAN G63 | 0.47541 | 0.6875 |
13 | G2F BGC BGC BGC BGC BGC | 0.46875 | 0.868421 |
14 | MAN BMA BMA | 0.467742 | 0.942857 |
15 | NOJ GLC | 0.466667 | 0.733333 |
16 | XYS GLC GLC | 0.462687 | 0.914286 |
17 | LG9 GLC | 0.460317 | 0.603774 |
18 | GYP | 0.458333 | 0.857143 |
19 | MMA | 0.458333 | 0.857143 |
20 | AMG | 0.458333 | 0.857143 |
21 | MBG | 0.458333 | 0.857143 |
22 | GLC BGC BGC BGC | 0.457627 | 0.941176 |
23 | BGC BGC BGC BGC BGC BGC BGC | 0.457627 | 0.941176 |
24 | BGC BGC BGC BGC BGC BGC | 0.457627 | 0.941176 |
25 | BGC BGC BGC BGC BGC | 0.457627 | 0.941176 |
26 | BGC BGC BGC | 0.457627 | 0.941176 |
27 | MBG GAL | 0.45614 | 0.888889 |
28 | MGL GAL | 0.45614 | 0.888889 |
29 | BGC GLA GAL | 0.454545 | 0.941176 |
30 | IFM BGC | 0.45 | 0.711111 |
31 | RR7 GLC | 0.448276 | 0.888889 |
32 | XYS XYS AHR | 0.447761 | 0.864865 |
33 | XYP XYP AHR | 0.447761 | 0.864865 |
34 | MAN MAN BMA | 0.446154 | 0.942857 |
35 | NAG BMA | 0.446154 | 0.6875 |
36 | NAG GAL | 0.444444 | 0.695652 |
37 | BDF GLC | 0.444444 | 0.916667 |
38 | MAN MNM | 0.442623 | 0.666667 |
39 | NOY BGC | 0.442623 | 0.666667 |
40 | GLC DMJ | 0.442623 | 0.733333 |
41 | GLC GLC GLC GLC BGC GLC GLC | 0.440678 | 0.941176 |
42 | MAN BMA BMA BMA BMA BMA BMA | 0.440678 | 0.941176 |
43 | BGC BGC BGC BGC BGC BGC BGC BGC BGC | 0.440678 | 0.941176 |
44 | CJX | 0.435484 | 0.680851 |
45 | 5QP | 0.433333 | 0.941176 |
46 | FRU GLC | 0.433333 | 0.794872 |
47 | BGC OXZ | 0.42623 | 0.666667 |
48 | 9MR | 0.42623 | 0.744186 |
49 | XYP XYP AHR XYP | 0.424658 | 0.864865 |
50 | BGC FUC GAL | 0.424242 | 0.914286 |
51 | GLC BGC FUC GAL | 0.424242 | 0.914286 |
52 | GLC G6P | 0.423729 | 0.744186 |
53 | AHR FUB | 0.423077 | 0.805556 |
54 | A2G GAL | 0.421875 | 0.695652 |
55 | FUC GAL | 0.416667 | 0.885714 |
56 | XYS AHR XYP XYP XYP | 0.416667 | 0.864865 |
57 | BMA MAN MAN | 0.415385 | 0.941176 |
58 | GLC 7LQ | 0.412698 | 0.885714 |
59 | BGC XGP | 0.412698 | 0.744186 |
60 | GCU BGC | 0.412698 | 0.861111 |
61 | ABL | 0.412698 | 0.666667 |
62 | XYP XYP XYP AHR | 0.410959 | 0.864865 |
63 | MAN IPD MAN | 0.409836 | 0.744186 |
64 | DGO MAN | 0.409836 | 0.914286 |
65 | FRU BMA | 0.409836 | 0.794872 |
66 | GLC U8V | 0.409836 | 0.864865 |
67 | GAL FUC GAL | 0.409091 | 0.914286 |
68 | XYP XYP XYP AHR XYP | 0.407895 | 0.864865 |
69 | GDQ GLC | 0.40625 | 0.666667 |
70 | BGC GAL GLA | 0.40625 | 0.941176 |
71 | GLC GLC GLC | 0.405797 | 0.942857 |
72 | IPD MAN | 0.403226 | 0.697674 |
73 | GLC EDO GLC | 0.403226 | 0.888889 |
74 | GAL SO4 GAL | 0.402985 | 0.627451 |
75 | G2F SHG BGC BGC | 0.4 | 0.842105 |
76 | MGC GAL | 0.4 | 0.666667 |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | MMA MAN | 0.9802 |
2 | DMJ MAN | 0.9768 |
3 | ZEL MAN | 0.9637 |
4 | MAN GLC | 0.9624 |
5 | MAN IFM | 0.9559 |
6 | BMA MAN | 0.9430 |
7 | GLC GLC | 0.9325 |
8 | MSX MAN | 0.9314 |
9 | IFM MAN | 0.9292 |
10 | MMA LDY | 0.9235 |
11 | GLC FRU | 0.9233 |
12 | DGO Z61 | 0.9199 |
13 | Z5L MAN | 0.9176 |
14 | BMA GLA | 0.9175 |
15 | MAN MVL | 0.9160 |
16 | BGC GLC | 0.9156 |
17 | GLA GLC | 0.9115 |
18 | GLC GLA | 0.9098 |
19 | GMH GMH | 0.9093 |
20 | XMM | 0.9053 |
21 | TW7 GLC | 0.8865 |
22 | BGC GLA | 0.8855 |
23 | BMA MVL | 0.8770 |
24 | SER MAN | 0.8766 |
25 | MVL BMA | 0.8669 |
26 | GLA BEZ | 0.8637 |
27 | RNK | 0.8586 |
28 | EGA GLA | 0.8573 |
29 | DTK | 0.8572 |
30 | BGC BGC | 0.8559 |
31 | SGC GLC | 0.8509 |
This union binding pocket(no: 1) in the query (biounit: 2jdu.bio1) has 13 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 2jdu.bio1) has 13 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |