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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 | 3WWX | - | DIA | C8 H20 N2 | C(CCCCN)CC.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 7 families. | |||||
1 | 1IKI | - | REY | C12 H21 N3 O6 | C[C@H](C(=.... |
2 | 1HVB | - | CEH | C32 H42 N6 O13 S | C[C@H](C(=.... |
3 | 1PW1 | - | HEL | C17 H25 N4 O7 S | CC1([C@@H].... |
4 | 1YQS | - | BSA | C9 H11 N O4 S | c1ccc(cc1).... |
5 | 1IKG | - | REX | C15 H26 N4 O7 | C[C@H](C(=.... |
6 | 3WWX | - | DIA | C8 H20 N2 | C(CCCCN)CC.... |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | SPD | 0.9929 |
2 | D10 | 0.9682 |
3 | HPL | 0.9633 |
4 | ODI | 0.9633 |
5 | OYA | 0.9579 |
6 | OC9 | 0.9441 |
7 | OCA | 0.9410 |
8 | 37Z | 0.9336 |
9 | OCT | 0.9310 |
10 | SS9 | 0.9265 |
11 | DE1 | 0.9246 |
12 | 7XA | 0.9244 |
13 | AE3 | 0.9237 |
14 | DKA | 0.9218 |
15 | N8C | 0.9203 |
16 | 4DI | 0.9201 |
17 | NWH | 0.9197 |
18 | LPA | 0.9186 |
19 | KNA | 0.9178 |
20 | TEG | 0.9176 |
21 | MLZ | 0.9154 |
22 | PML | 0.9125 |
23 | HNE | 0.9116 |
24 | 3OL | 0.9097 |
25 | 9J6 | 0.9095 |
26 | FXY | 0.9077 |
27 | NOT | 0.9071 |
28 | ARG | 0.9064 |
29 | NMH | 0.9064 |
30 | GRQ | 0.9056 |
31 | GVA | 0.9050 |
32 | EXY | 0.9037 |
33 | ENW | 0.9013 |
34 | HPN | 0.9002 |
35 | AG2 | 0.9001 |
36 | ENV | 0.9000 |
37 | N6C | 0.8991 |
38 | LYS | 0.8985 |
39 | U4G | 0.8980 |
40 | 3OM | 0.8978 |
41 | BHL | 0.8969 |
42 | SLZ | 0.8967 |
43 | NTU | 0.8959 |
44 | NSD | 0.8953 |
45 | SSB | 0.8950 |
46 | M1T | 0.8945 |
47 | HRG | 0.8944 |
48 | HE4 | 0.8938 |
49 | DAR | 0.8934 |
50 | JX7 | 0.8919 |
51 | MHN | 0.8918 |
52 | ACA | 0.8912 |
53 | 5UF | 0.8896 |
54 | X1R | 0.8890 |
55 | OKP | 0.8890 |
56 | SHV | 0.8885 |
57 | GGG | 0.8863 |
58 | 64Z | 0.8856 |
59 | NF3 | 0.8844 |
60 | 0L1 | 0.8839 |
61 | 58X | 0.8826 |
62 | KAP | 0.8823 |
63 | 2J3 | 0.8814 |
64 | GGB | 0.8812 |
65 | AJ3 | 0.8811 |
66 | NPI | 0.8810 |
67 | PG0 | 0.8802 |
68 | MGB | 0.8801 |
69 | GLY GLY GLY | 0.8792 |
70 | PUW | 0.8789 |
71 | 6XA | 0.8782 |
72 | HPO | 0.8770 |
73 | XOG | 0.8756 |
74 | M3L | 0.8751 |
75 | RED | 0.8729 |
76 | 1H1 | 0.8728 |
77 | ALY | 0.8723 |
78 | HAR | 0.8697 |
79 | 7UC | 0.8691 |
80 | 9OD | 0.8679 |
81 | OHJ | 0.8677 |
82 | 4JK | 0.8633 |
83 | A98 | 0.8555 |
84 | MVH | 0.8540 |
This union binding pocket(no: 1) in the query (biounit: 3wwx.bio1) has 10 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |