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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 277 families. | |||||
1 | 4JD0 | - | 1KH | C5 H13 As O8 | C([C@H]([C.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 212 families. | |||||
1 | 4JD0 | - | 1KH | C5 H13 As O8 | C([C@H]([C.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | 1KH | 1 | 1 |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | EVA | 0.9013 |
2 | GCB | 0.8994 |
3 | LKA | 0.8984 |
4 | BGC | 0.8976 |
5 | GCU | 0.8964 |
6 | OA3 | 0.8906 |
7 | GCS | 0.8879 |
8 | BDP | 0.8876 |
9 | BNT | 0.8873 |
10 | GLC | 0.8864 |
11 | G3F | 0.8856 |
12 | LAO | 0.8842 |
13 | SHG | 0.8837 |
14 | 4ME | 0.8835 |
15 | LGC | 0.8818 |
16 | GCW | 0.8809 |
17 | 5WY | 0.8803 |
18 | 8S0 | 0.8763 |
19 | 42C | 0.8755 |
20 | JTH | 0.8754 |
21 | 5RP | 0.8742 |
22 | PPK | 0.8741 |
23 | 3RI | 0.8733 |
24 | GAL | 0.8733 |
25 | 8GK | 0.8714 |
26 | 2H5 | 0.8698 |
27 | M0Q | 0.8697 |
28 | GCO | 0.8682 |
29 | GLA | 0.8666 |
30 | 3C2 | 0.8662 |
31 | G2F | 0.8644 |
32 | SOR | 0.8642 |
33 | NOJ | 0.8635 |
34 | GTR | 0.8630 |
35 | GCV | 0.8627 |
36 | 1Z8 | 0.8624 |
37 | 7ZE | 0.8620 |
38 | VK3 | 0.8618 |
39 | DBJ | 0.8606 |
40 | 3C1 | 0.8600 |
41 | 2ZQ | 0.8594 |
42 | 2FG | 0.8587 |
43 | SXS | 0.8583 |
44 | KBG | 0.8575 |
45 | 3MG | 0.8569 |
46 | EXO | 0.8561 |
47 | MBG | 0.8561 |
48 | PA1 | 0.8558 |
49 | M5N | 0.8553 |
50 | CTS | 0.8545 |
51 | PRZ | 0.8542 |
52 | HNQ | 0.8540 |
53 | AIN | 0.8537 |
54 | BMA | 0.8534 |
This union binding pocket(no: 1) in the query (biounit: 4jd0.bio1) has 13 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |