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- Structure Biounit | Ligand Information
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No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 7 families. | |||||
1 | 5UQM | - | U2F | C15 H23 F N2 O16 P2 | C1=CN(C(=O.... |
2 | 2BVL | - | GLC | C6 H12 O6 | C([C@@H]1[.... |
3 | 5UQN | - | U2F | C15 H23 F N2 O16 P2 | C1=CN(C(=O.... |
4 | 2VKH | - | UPG | C15 H24 N2 O17 P2 | C1=CN(C(=O.... |
5 | 2VL8 | ic50 ~ 30 uM | CTS | C8 H15 N O4 | C1C[N@]2C[.... |
6 | 5UQK | - | U2F | C15 H23 F N2 O16 P2 | C1=CN(C(=O.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 5 families. | |||||
1 | 5UQM | - | U2F | C15 H23 F N2 O16 P2 | C1=CN(C(=O.... |
2 | 2BVL | - | GLC | C6 H12 O6 | C([C@@H]1[.... |
3 | 5UQN | - | U2F | C15 H23 F N2 O16 P2 | C1=CN(C(=O.... |
4 | 2VKH | - | UPG | C15 H24 N2 O17 P2 | C1=CN(C(=O.... |
5 | 2VL8 | ic50 ~ 30 uM | CTS | C8 H15 N O4 | C1C[N@]2C[.... |
6 | 4DMW | - | UDP | C9 H14 N2 O12 P2 | C1=CN(C(=O.... |
7 | 5UQL | - | U2F | C15 H23 F N2 O16 P2 | C1=CN(C(=O.... |
8 | 5UQK | - | U2F | C15 H23 F N2 O16 P2 | C1=CN(C(=O.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | U2F | 1 | 1 |
2 | UPF | 1 | 1 |
3 | GDU | 0.797619 | 0.943662 |
4 | UFM | 0.797619 | 0.943662 |
5 | UPG | 0.797619 | 0.943662 |
6 | UFG | 0.790698 | 1 |
7 | UGF | 0.725275 | 0.985915 |
8 | UD1 | 0.697917 | 0.930556 |
9 | UD2 | 0.697917 | 0.930556 |
10 | UDP | 0.691358 | 0.888889 |
11 | AWU | 0.688889 | 0.916667 |
12 | UTP | 0.686747 | 0.888889 |
13 | U5F | 0.678571 | 0.888889 |
14 | USQ | 0.677419 | 0.804878 |
15 | UAD | 0.673913 | 0.916667 |
16 | UDX | 0.673913 | 0.916667 |
17 | UGB | 0.659574 | 0.929577 |
18 | UGA | 0.659574 | 0.929577 |
19 | G3N | 0.652632 | 0.891892 |
20 | UPU | 0.647727 | 0.915493 |
21 | 3UC | 0.645833 | 1 |
22 | U5P | 0.6375 | 0.875 |
23 | U | 0.6375 | 0.875 |
24 | UNP | 0.625 | 0.864865 |
25 | URM | 0.623656 | 0.90411 |
26 | 660 | 0.623656 | 0.90411 |
27 | EPZ | 0.616822 | 0.917808 |
28 | MJZ | 0.61165 | 0.891892 |
29 | EPU | 0.611111 | 0.905405 |
30 | EEB | 0.611111 | 0.905405 |
31 | F5P | 0.605769 | 0.891892 |
32 | UD4 | 0.605769 | 0.891892 |
33 | HP7 | 0.601942 | 0.916667 |
34 | UD7 | 0.601942 | 0.90411 |
35 | UDH | 0.595745 | 0.822785 |
36 | UPP | 0.595745 | 0.890411 |
37 | 44P | 0.595238 | 0.853333 |
38 | IUG | 0.59434 | 0.795181 |
39 | F5G | 0.590476 | 0.90411 |
40 | UDP GAL | 0.587629 | 0.916667 |
41 | UDZ | 0.583333 | 0.835443 |
42 | UMA | 0.568965 | 0.917808 |
43 | 2KH | 0.566667 | 0.864865 |
44 | UDM | 0.563107 | 0.891892 |
45 | HWU | 0.560748 | 0.88 |
46 | 12V | 0.560748 | 0.88 |
47 | UDP UDP | 0.556818 | 0.861111 |
48 | Y6W | 0.55102 | 0.868421 |
49 | C5G | 0.55 | 0.893333 |
50 | U21 | 0.540984 | 0.817073 |
51 | U22 | 0.540984 | 0.797619 |
52 | U20 | 0.540984 | 0.817073 |
53 | URI | 0.531646 | 0.816901 |
54 | UP5 | 0.513274 | 0.8125 |
55 | 2GW | 0.509259 | 0.905405 |
56 | UAG | 0.5 | 0.87013 |
57 | 2QR | 0.496063 | 0.807229 |
58 | UA3 | 0.494253 | 0.861111 |
59 | U3P | 0.494253 | 0.861111 |
60 | CJB | 0.493976 | 0.802817 |
61 | 4TC | 0.491379 | 0.792683 |
62 | CSQ | 0.490741 | 0.833333 |
63 | CSV | 0.490741 | 0.833333 |
64 | 1GW | 0.478261 | 0.87013 |
65 | DKX | 0.476744 | 0.830986 |
66 | UD0 | 0.474074 | 0.804878 |
67 | UMF | 0.47191 | 0.888889 |
68 | 4RA | 0.470149 | 0.814815 |
69 | PUP | 0.466667 | 0.84 |
70 | U2P | 0.460674 | 0.875 |
71 | UML | 0.458333 | 0.817073 |
72 | CXY | 0.444444 | 0.868421 |
73 | HF4 | 0.434343 | 0.842105 |
74 | CTP | 0.434343 | 0.842105 |
75 | CDP | 0.43299 | 0.842105 |
76 | BUP | 0.43 | 0.905405 |
77 | FZK | 0.427184 | 0.744186 |
78 | DUT | 0.42 | 0.815789 |
79 | 5FU | 0.419355 | 0.917808 |
80 | U4S | 0.419355 | 0.696203 |
81 | 7XL | 0.417476 | 0.844156 |
82 | 0RC | 0.417476 | 0.822785 |
83 | LSU | 0.411215 | 0.688889 |
84 | DAU | 0.410714 | 0.846154 |
85 | U3S | 0.410526 | 0.717949 |
86 | U2S | 0.410526 | 0.730769 |
87 | 5GW | 0.409524 | 0.866667 |
88 | DUD | 0.408163 | 0.815789 |
89 | UPA | 0.406504 | 0.825 |
90 | C2G | 0.40566 | 0.855263 |
91 | U1S | 0.403846 | 0.7375 |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | 3R2 | 0.8631 |
This union binding pocket(no: 1) in the query (biounit: 5uqk.bio1) has 25 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
1 | 6RTG | UDP | 36.2764 |