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- Structure Biounit | Ligand Information
- PDB : .ZIP | .CSV
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- Class : .ZIP | .CSV
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 1 families. | |||||
1 | 5YE8 | ic50 ~ 1 mM | 8U3 | C7 H7 F2 N O2 S | CS(=O)(=O).... |
2 | 5JAH | - | 6HQ | C6 H10 N2 O2 | CC1(C(=O)N.... |
3 | 5JAP | ic50 = 0.23 uM | 6HZ | C19 H19 N O | Cc1ccccc1c.... |
4 | 5LZ4 | Kd = 2 uM | 7BW | C15 H17 F N2 O2 | CC1(CC(=O).... |
5 | 5JAL | Kd = 980 uM | 6HO | C11 H10 F N O | c1cc(cc(c1.... |
6 | 5YE9 | ic50 = 355 nM | 8U6 | C25 H19 N3 O4 S | CC(=O)Nc1c.... |
7 | 5JAN | - | 6HP | C10 H16 N2 O3 | CC(C)COC1=.... |
8 | 5JAS | ic50 = 1.7 uM | 6HW | C17 H16 N2 S | Cc1ccccc1c.... |
9 | 5LZ9 | ic50 = 0.12 uM | 7BR | C19 H23 F N2 O4 S | CC1(CCS(=O.... |
10 | 5LZ2 | ic50 ~ 1 mM | 7BX | C10 H10 N2 O2 S | c1cc(cc(c1.... |
11 | 5YE7 | ic50 = 3431 nM | 8U0 | C24 H20 N2 O4 S | CC(=O)Nc1c.... |
12 | 5JAT | ic50 = 0.23 uM | 6HR | C20 H22 N2 O S | Cc1ccccc1c.... |
13 | 5LZ8 | ic50 = 0.98 uM | 7BP | C17 H21 F N2 O2 | CC(C)(C)[C.... |
14 | 5JAU | ic50 = 0.0014 uM | 6HU | C23 H30 N4 O3 | Cc1ccccc1c.... |
15 | 5LZ7 | Kd = 0.53 uM | 7BK | C20 H19 F N2 O2 | C[C@@]1(CC.... |
16 | 5YEA | ic50 = 5 nM | 8U9 | C21 H12 Cl F3 N2 O5 S | c1cc(ccc1C.... |
17 | 5LYY | ic50 = 14 uM | 7BJ | C16 H19 F N2 O3 | c1cc(ccc1O.... |
18 | 5LP1 | ic50 = 0.398 nM | 71H | C35 H38 F4 N4 O2 S | CCN(CC)CCN.... |
19 | 5JAR | ic50 = 2 uM | 6HV | C18 H15 N O S | Cc1ccccc1c.... |
20 | 5LZ5 | Kd = 0.45 uM | 7K4 | C20 H19 F N2 O2 | C[C@]1(CC(.... |
21 | 5I8P | Kd = 0.000000064 M | VQ7 | C23 H19 Cl F5 N3 O5 S | CN1C(=CC(=.... |
22 | 5JAD | Kd = 3.4 mM | FB2 | C6 H7 N O2 S | c1ccc(cc1).... |
23 | 5JAO | - | 6HX | C13 H12 Cl N | Cc1ccc(cc1.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 1 families. | |||||
1 | 5YE8 | ic50 ~ 1 mM | 8U3 | C7 H7 F2 N O2 S | CS(=O)(=O).... |
2 | 5JAH | - | 6HQ | C6 H10 N2 O2 | CC1(C(=O)N.... |
3 | 5JAP | ic50 = 0.23 uM | 6HZ | C19 H19 N O | Cc1ccccc1c.... |
4 | 5LZ4 | Kd = 2 uM | 7BW | C15 H17 F N2 O2 | CC1(CC(=O).... |
5 | 5JAL | Kd = 980 uM | 6HO | C11 H10 F N O | c1cc(cc(c1.... |
6 | 5YE9 | ic50 = 355 nM | 8U6 | C25 H19 N3 O4 S | CC(=O)Nc1c.... |
7 | 5JAN | - | 6HP | C10 H16 N2 O3 | CC(C)COC1=.... |
8 | 5JAS | ic50 = 1.7 uM | 6HW | C17 H16 N2 S | Cc1ccccc1c.... |
9 | 5LZ9 | ic50 = 0.12 uM | 7BR | C19 H23 F N2 O4 S | CC1(CCS(=O.... |
10 | 5LZ2 | ic50 ~ 1 mM | 7BX | C10 H10 N2 O2 S | c1cc(cc(c1.... |
11 | 5YE7 | ic50 = 3431 nM | 8U0 | C24 H20 N2 O4 S | CC(=O)Nc1c.... |
12 | 5JAT | ic50 = 0.23 uM | 6HR | C20 H22 N2 O S | Cc1ccccc1c.... |
13 | 5LZ8 | ic50 = 0.98 uM | 7BP | C17 H21 F N2 O2 | CC(C)(C)[C.... |
14 | 5JAU | ic50 = 0.0014 uM | 6HU | C23 H30 N4 O3 | Cc1ccccc1c.... |
15 | 5LZ7 | Kd = 0.53 uM | 7BK | C20 H19 F N2 O2 | C[C@@]1(CC.... |
16 | 5YEA | ic50 = 5 nM | 8U9 | C21 H12 Cl F3 N2 O5 S | c1cc(ccc1C.... |
17 | 5LYY | ic50 = 14 uM | 7BJ | C16 H19 F N2 O3 | c1cc(ccc1O.... |
18 | 5LP1 | ic50 = 0.398 nM | 71H | C35 H38 F4 N4 O2 S | CCN(CC)CCN.... |
19 | 5JAR | ic50 = 2 uM | 6HV | C18 H15 N O S | Cc1ccccc1c.... |
20 | 5LZ5 | Kd = 0.45 uM | 7K4 | C20 H19 F N2 O2 | C[C@]1(CC(.... |
21 | 5I8P | Kd = 0.000000064 M | VQ7 | C23 H19 Cl F5 N3 O5 S | CN1C(=CC(=.... |
22 | 5JAD | Kd = 3.4 mM | FB2 | C6 H7 N O2 S | c1ccc(cc1).... |
23 | 5JAO | - | 6HX | C13 H12 Cl N | Cc1ccc(cc1.... |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | 6HZ | 0.9621 |
2 | 4ZK | 0.9277 |
3 | FOY | 0.9175 |
4 | 1TM | 0.9111 |
5 | 8XT | 0.9089 |
6 | KTK | 0.9074 |
7 | 9F5 | 0.9062 |
8 | U5P | 0.9038 |
9 | T1D | 0.8993 |
10 | C5P | 0.8969 |
11 | 6JJ | 0.8959 |
12 | 362 | 0.8931 |
13 | HHB | 0.8919 |
14 | 2GE | 0.8918 |
15 | 4UB | 0.8910 |
16 | UP6 | 0.8879 |
17 | AED | 0.8865 |
18 | C9Q | 0.8864 |
19 | 9JQ | 0.8856 |
20 | 9JW | 0.8855 |
21 | U | 0.8832 |
22 | GUS | 0.8809 |
23 | FX5 | 0.8802 |
24 | K6B | 0.8792 |
25 | 5Q6 | 0.8788 |
26 | PDB | 0.8745 |
27 | 6QO | 0.8732 |
28 | PZB | 0.8729 |
29 | HKK | 0.8728 |
30 | 69W | 0.8714 |
31 | ROL | 0.8704 |
32 | DRM | 0.8695 |
33 | PRO GLY ALA | 0.8671 |
34 | JWD | 0.8636 |
35 | AMP | 0.8634 |
36 | 9XZ | 0.8632 |
37 | 6QU | 0.8610 |
38 | S0K | 0.8579 |
39 | 73U | 0.8577 |
40 | NLD | 0.8563 |
41 | 9ST | 0.8561 |
42 | BTD | 0.8549 |
43 | GG5 | 0.8545 |
This union binding pocket(no: 1) in the query (biounit: 5lp1.bio1) has 30 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |