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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 271 families. | |||||
1 | 5KD8 | - | TNR | C11 H20 N2 O8 | CC(=O)N[C@.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 223 families. | |||||
1 | 5KD8 | - | TNR | C11 H20 N2 O8 | CC(=O)N[C@.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | TNR | 1 | 1 |
2 | 3YW | 0.683333 | 0.895833 |
3 | SER A2G | 0.650794 | 0.979592 |
4 | 2F8 | 0.559322 | 0.84 |
5 | MAG | 0.559322 | 0.84 |
6 | GN1 | 0.548387 | 0.741379 |
7 | NG1 | 0.548387 | 0.741379 |
8 | GAL NAG | 0.536232 | 0.86 |
9 | A2G SER GAL | 0.513158 | 0.941176 |
10 | MAN NAG | 0.492754 | 0.86 |
11 | NDG NAG | 0.486111 | 0.865385 |
12 | A2G NAG | 0.478873 | 0.882353 |
13 | MBG NAG | 0.478873 | 0.826923 |
14 | A2G GAL NAG | 0.475 | 0.882353 |
15 | MBG A2G | 0.472222 | 0.826923 |
16 | GYU | 0.464789 | 0.854545 |
17 | 57S | 0.461538 | 0.762712 |
18 | ACE SER SER VAL GLY A2G | 0.460674 | 0.87037 |
19 | GDL NAG | 0.458333 | 0.882353 |
20 | NM9 NAG | 0.45 | 0.867925 |
21 | HD4 | 0.448718 | 0.762712 |
22 | MA8 | 0.445946 | 0.901961 |
23 | GAL NGA | 0.445946 | 0.843137 |
24 | GAL NGA A2G | 0.441558 | 0.882353 |
25 | Z3Q NGA | 0.439024 | 0.783333 |
26 | NGA THR GAL NAG | 0.434783 | 0.867925 |
27 | NAG NAG NAG NAG NAG NAG NAG NAG | 0.434211 | 0.865385 |
28 | NAG NAG NAG NAG NAG NAG | 0.434211 | 0.865385 |
29 | NAG NAG NAG NAG NAG | 0.434211 | 0.865385 |
30 | NDG NAG NAG NAG NAG | 0.434211 | 0.865385 |
31 | LEC | 0.428571 | 0.676923 |
32 | 6ZC | 0.428571 | 0.676923 |
33 | HSQ | 0.42623 | 0.833333 |
34 | A2G | 0.42623 | 0.833333 |
35 | NDG | 0.42623 | 0.833333 |
36 | BM3 | 0.42623 | 0.833333 |
37 | NAG | 0.42623 | 0.833333 |
38 | NGA | 0.42623 | 0.833333 |
39 | MMA MAN NAG | 0.425 | 0.826923 |
40 | AMU NAG | 0.421687 | 0.849057 |
41 | BMA MAN NAG | 0.419753 | 0.86 |
42 | GAL FUC A2G | 0.419753 | 0.843137 |
43 | NAG NGO | 0.419753 | 0.803571 |
44 | BGC GAL NGA | 0.417722 | 0.86 |
45 | GYT | 0.417722 | 0.783333 |
46 | 3QL | 0.417722 | 0.818182 |
47 | SNG | 0.415385 | 0.769231 |
48 | A2G THR GAL NAG | 0.408602 | 0.867925 |
49 | AH0 NAG | 0.404762 | 0.789474 |
50 | AMV NAG AMU NAG | 0.4 | 0.833333 |
51 | RWI | 0.4 | 0.733333 |
No: | Ligand | Similarity coefficient |
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