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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 | 5B0J | - | UMQ | C23 H44 O11 | CCCCCCCCCC.... |
2 | 5B0I | - | BOG | C14 H28 O6 | CCCCCCCCO[.... |
3 | 6J8W | - | C0X | C20 H35 O7 P | CC(=CCC/C(.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 322 families. | |||||
1 | 5B0J | - | UMQ | C23 H44 O11 | CCCCCCCCCC.... |
2 | 5B0I | - | BOG | C14 H28 O6 | CCCCCCCCO[.... |
3 | 6J8W | - | C0X | C20 H35 O7 P | CC(=CCC/C(.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | LMU | 1 | 1 |
2 | UMQ | 1 | 1 |
3 | DMU | 1 | 1 |
4 | LMT | 1 | 1 |
5 | GLC NBU GAL GLA | 0.8 | 0.928571 |
6 | 6UZ | 0.738462 | 0.840909 |
7 | BGC 5VQ GAL GLA | 0.721311 | 0.880952 |
8 | BNG | 0.719298 | 0.952381 |
9 | BOG | 0.719298 | 0.952381 |
10 | HSJ | 0.719298 | 0.952381 |
11 | B7G | 0.701754 | 0.952381 |
12 | KGM | 0.701754 | 0.952381 |
13 | GLC EDO GLC | 0.683333 | 0.790698 |
14 | MA4 | 0.676056 | 0.880952 |
15 | AFO | 0.666667 | 0.863636 |
16 | CM5 | 0.661972 | 0.880952 |
17 | BHG | 0.655172 | 0.928571 |
18 | HEX GLC | 0.655172 | 0.928571 |
19 | JZR | 0.655172 | 0.928571 |
20 | 10M | 0.583333 | 0.933333 |
21 | BGC GLA GAL | 0.566667 | 0.785714 |
22 | MGL GAL | 0.564516 | 0.790698 |
23 | BHE | 0.561644 | 0.976744 |
24 | CQX | 0.558824 | 0.930233 |
25 | BGC SPH GAL DAO | 0.55814 | 0.777778 |
26 | BGC SPH GAL OLA | 0.55814 | 0.777778 |
27 | DEG | 0.55 | 0.857143 |
28 | OPM MAN MAN | 0.546667 | 0.97619 |
29 | L6T | 0.535211 | 0.976744 |
30 | HSH GLA FUC | 0.532468 | 0.976744 |
31 | AOG FUC | 0.526316 | 0.807692 |
32 | MAN BMA BMA BMA BMA BMA BMA | 0.523077 | 0.785714 |
33 | GLC GLC GLC GLC BGC GLC GLC | 0.523077 | 0.785714 |
34 | BGC BGC BGC BGC BGC BGC BGC BGC BGC | 0.523077 | 0.785714 |
35 | BGC SPH GAL OCA | 0.521739 | 0.75 |
36 | BGC 18C GAL | 0.521739 | 0.75 |
37 | 4YA | 0.513514 | 0.976744 |
38 | LSE | 0.506667 | 0.698113 |
39 | GLC GLC GLC GLC GLC GLC GLC GLC GLC | 0.506667 | 0.785714 |
40 | BGC XGP | 0.492754 | 0.647059 |
41 | XNS | 0.486111 | 0.863636 |
42 | DR4 | 0.486111 | 0.863636 |
43 | NAG GAL BGC GAL | 0.481481 | 0.641509 |
44 | AIG FUC | 0.480519 | 0.807692 |
45 | IGC | 0.48 | 0.75 |
46 | LGN | 0.48 | 0.75 |
47 | G2F SHG BGC BGC | 0.478873 | 0.717391 |
48 | MAN BMA BMA | 0.478873 | 0.790698 |
49 | BMA BMA BMA BMA GLA | 0.467532 | 0.785714 |
50 | GPM GLC | 0.464789 | 0.666667 |
51 | U2D GLC | 0.461538 | 0.976744 |
52 | G2F BGC BGC BGC BGC BGC | 0.459459 | 0.73913 |
53 | BGC BGC BGC BGC BGC BGC BGC BGC | 0.459459 | 0.785714 |
54 | BQZ | 0.459016 | 0.714286 |
55 | FK9 | 0.457143 | 0.863636 |
56 | BGL | 0.455882 | 0.952381 |
57 | GLC GLC GLC GLC GLC | 0.454545 | 0.785714 |
58 | BGC GLC GLC GLC | 0.454545 | 0.785714 |
59 | FRU BGC BGC BGC | 0.453333 | 0.73913 |
60 | BGC ERA GAL | 0.451923 | 0.736842 |
61 | G2I | 0.447368 | 0.666667 |
62 | G3I | 0.447368 | 0.666667 |
63 | BGC OXZ BGC | 0.447368 | 0.607143 |
64 | MBG GLA | 0.446154 | 0.790698 |
65 | DA8 | 0.444444 | 0.931818 |
66 | BGC GAL GLA | 0.444444 | 0.785714 |
67 | SOR GLC GLC | 0.441558 | 0.767442 |
68 | BGC GLC GLC | 0.44 | 0.785714 |
69 | XYS GLC GLC | 0.435897 | 0.767442 |
70 | GLC BGC BGC | 0.43038 | 0.75 |
71 | GLO GLC GLC | 0.426829 | 0.75 |
72 | GLC GLC G6D ADH GLC GLC | 0.425 | 0.6 |
73 | MGL SGC BGC BGC | 0.421687 | 0.73913 |
74 | NAG GAL | 0.418919 | 0.641509 |
75 | GAL GLA | 0.41791 | 0.785714 |
76 | GLO GLC GLC GLC | 0.416667 | 0.75 |
77 | BGC GAL NGA GAL | 0.416667 | 0.641509 |
78 | FUC GAL | 0.414286 | 0.785714 |
79 | BMA BMA BMA BMA GLA BMA GLA | 0.409091 | 0.733333 |
80 | MAN IPD MAN | 0.408451 | 0.647059 |
81 | GTM BGC BGC | 0.407407 | 0.73913 |
82 | MBG GAL | 0.405797 | 0.790698 |
83 | MGL SGC | 0.402778 | 0.73913 |
84 | BHG FUC | 0.402439 | 0.931818 |
85 | RR7 GLC | 0.4 | 0.790698 |
No: | Ligand | Similarity coefficient |
---|
This union binding pocket(no: 1) in the query (biounit: 5b0i.bio1) has 16 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 5b0i.bio1) has 13 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 3) in the query (biounit: 5b0i.bio1) has 16 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 4) in the query (biounit: 5b0i.bio2) has 25 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 5) in the query (biounit: 5b0i.bio2) has 32 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |