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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 3 families. | |||||
1 | 1J8V | Ki = 243.2 uM | LAM | C24 H35 N O17 S | c1cc(ccc1[.... |
2 | 1IEX | - | SGC BGC | n/a | n/a |
3 | 6MI1 | Kd = 0.000000064 M | U1Y BGC | n/a | n/a |
4 | 1X38 | Ki = 1.7 nM | IDD | C14 H16 N2 O4 | c1ccc(cc1).... |
5 | 1X39 | Ki = 0.6 nM | IDE | C15 H19 N3 O4 | c1ccc(cc1).... |
6 | 1EX1 | - | GLC | C6 H12 O6 | C([C@@H]1[.... |
7 | 6MD6 | Ki = 0.00255 M | U2A BGC | n/a | n/a |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 3 families. | |||||
1 | 1J8V | Ki = 243.2 uM | LAM | C24 H35 N O17 S | c1cc(ccc1[.... |
2 | 1IEX | - | SGC BGC | n/a | n/a |
3 | 6MI1 | Kd = 0.000000064 M | U1Y BGC | n/a | n/a |
4 | 1X38 | Ki = 1.7 nM | IDD | C14 H16 N2 O4 | c1ccc(cc1).... |
5 | 1X39 | Ki = 0.6 nM | IDE | C15 H19 N3 O4 | c1ccc(cc1).... |
6 | 1EX1 | - | GLC | C6 H12 O6 | C([C@@H]1[.... |
7 | 6MD6 | Ki = 0.00255 M | U2A BGC | n/a | n/a |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | PGI | 0.9613 |
2 | NHV | 0.9261 |
3 | QDR | 0.9117 |
4 | EXP | 0.9089 |
5 | 0RU | 0.9082 |
6 | EBB | 0.9067 |
7 | 8E6 | 0.9030 |
8 | C17 | 0.8994 |
9 | 4KN | 0.8993 |
10 | 1UA | 0.8960 |
11 | T5J | 0.8945 |
12 | BZD | 0.8945 |
13 | KVW | 0.8898 |
14 | C18 | 0.8896 |
15 | JZR | 0.8895 |
16 | EX7 | 0.8892 |
17 | AOB | 0.8888 |
18 | 8E3 | 0.8883 |
19 | GDV | 0.8867 |
20 | KOT | 0.8844 |
21 | 8EC | 0.8836 |
22 | 1UR | 0.8827 |
23 | 6MY | 0.8797 |
24 | PQD | 0.8795 |
25 | KVQ | 0.8792 |
26 | IW5 | 0.8775 |
27 | 5XM | 0.8774 |
28 | GJW | 0.8764 |
29 | M62 | 0.8763 |
30 | G50 | 0.8761 |
31 | KVN | 0.8750 |
32 | 4VR | 0.8747 |
33 | 73E | 0.8743 |
34 | F91 | 0.8730 |
35 | 9PC | 0.8728 |
36 | B1W | 0.8719 |
37 | NOJ BGC | 0.8719 |
38 | NNL | 0.8718 |
39 | 4JV | 0.8714 |
40 | KS2 | 0.8711 |
41 | 9OL | 0.8706 |
42 | ND5 | 0.8700 |
43 | IY5 | 0.8698 |
44 | B1N | 0.8694 |
45 | F08 | 0.8690 |
46 | 1UT | 0.8656 |
47 | ALJ | 0.8652 |
48 | GI2 | 0.8652 |
49 | 2ZI | 0.8650 |
50 | CMZ | 0.8623 |
51 | YC8 | 0.8619 |
52 | 68C | 0.8619 |
53 | ECZ | 0.8616 |
54 | 29F | 0.8609 |
55 | JZ8 | 0.8603 |
56 | JP8 | 0.8601 |
57 | LJ2 | 0.8597 |
58 | KUQ | 0.8595 |
59 | 1V0 | 0.8589 |
60 | OAN | 0.8583 |
61 | BOG | 0.8582 |
62 | 9C8 | 0.8569 |
63 | BBO | 0.8564 |
64 | 6BK | 0.8554 |
65 | 1VG | 0.8543 |
66 | W2E | 0.8538 |
67 | IW3 | 0.8516 |
This union binding pocket(no: 1) in the query (biounit: 1x39.bio1) has 20 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
1 | 4I3G | BGC | 22.093 |
2 | 6KJ0 | XYP | 36.3787 |