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No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 2 families. | |||||
1 | 2BU8 | - | TF4 | C2 H2 Cl2 O2 | C(C(=O)O)(.... |
2 | 1JM6 | - | ADP | C10 H15 N5 O10 P2 | c1nc(c2c(n.... |
3 | 6LIO | Kd = 64.4 nM | EH3 | C30 H34 Cl N3 O9 S | CS(=O)(=O).... |
4 | 2BU6 | - | TF2 | C19 H21 F3 N2 O4 S | CC[N@@](c1.... |
5 | 4MPN | Kd = 239 nM | PV0 | C14 H13 N O6 S | c1cc(c(cc1.... |
6 | 5M4M | Ki = 1.02 uM | 7FW | C31 H26 N4 O4 | CN(Cc1ccc2.... |
7 | 2BU7 | - | TF3 | C20 H25 Cl N2 O2 | CC(C)c1ccc.... |
8 | 5J71 | - | P35 | C19 H23 N3 O4 S | c1cc2c(cc1.... |
9 | 4MP2 | Kd = 3570 nM | PV1 | C15 H12 Br N O3 | c1ccc2c(c1.... |
10 | 4MPE | Kd = 426 nM | PV8 | C14 H13 N O5 S | c1cc2c(cc1.... |
11 | 5J6A | Kd = 22 nM | P46 | C23 H27 N5 O6 S | c1cc2cn(cc.... |
12 | 4V26 | - | TF3 | C20 H25 Cl N2 O2 | CC(C)c1ccc.... |
13 | 5M4P | - | TF3 | C20 H25 Cl N2 O2 | CC(C)c1ccc.... |
14 | 2BU5 | - | TF1 | C18 H20 F3 N3 O3 | C[C@H]1CN(.... |
15 | 2BU2 | - | TF1 | C18 H20 F3 N3 O3 | C[C@H]1CN(.... |
16 | 6LIL | - | EGX | C22 H19 N3 O2 | c1ccc2c(c1.... |
17 | 4MP7 | Kd = 1827 nM | PFT | C15 H13 N O3 | c1ccc2c(c1.... |
18 | 4MPC | Kd = 711 nM | PV2 | C14 H13 N O4 S | c1ccc2c(c1.... |
19 | 2Q8H | Ki = 1 mM | TF4 | C2 H2 Cl2 O2 | C(C(=O)O)(.... |
20 | 2Q8G | ic50 = 0.087 uM | AZX | C19 H18 Cl F3 N2 O5 S | C[C@@](C(=.... |
21 | 3D2R | Kd = 3.3 uM | ADP | C10 H15 N5 O10 P2 | c1nc(c2c(n.... |
22 | 2ZKJ | Kd = 3.3 uM | ADP | C10 H15 N5 O10 P2 | c1nc(c2c(n.... |
23 | 2ZDY | - | ADP | C10 H15 N5 O10 P2 | c1nc(c2c(n.... |
24 | 2E0A | - | ANP | C10 H17 N6 O12 P3 | c1nc(c2c(n.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 2 families. | |||||
1 | 2BU8 | - | TF4 | C2 H2 Cl2 O2 | C(C(=O)O)(.... |
2 | 1JM6 | - | ADP | C10 H15 N5 O10 P2 | c1nc(c2c(n.... |
3 | 6LIO | Kd = 64.4 nM | EH3 | C30 H34 Cl N3 O9 S | CS(=O)(=O).... |
4 | 2BU6 | - | TF2 | C19 H21 F3 N2 O4 S | CC[N@@](c1.... |
5 | 4MPN | Kd = 239 nM | PV0 | C14 H13 N O6 S | c1cc(c(cc1.... |
6 | 5M4M | Ki = 1.02 uM | 7FW | C31 H26 N4 O4 | CN(Cc1ccc2.... |
7 | 2BU7 | - | TF3 | C20 H25 Cl N2 O2 | CC(C)c1ccc.... |
8 | 5J71 | - | P35 | C19 H23 N3 O4 S | c1cc2c(cc1.... |
9 | 4MP2 | Kd = 3570 nM | PV1 | C15 H12 Br N O3 | c1ccc2c(c1.... |
10 | 4MPE | Kd = 426 nM | PV8 | C14 H13 N O5 S | c1cc2c(cc1.... |
11 | 5J6A | Kd = 22 nM | P46 | C23 H27 N5 O6 S | c1cc2cn(cc.... |
12 | 4V26 | - | TF3 | C20 H25 Cl N2 O2 | CC(C)c1ccc.... |
13 | 5M4P | - | TF3 | C20 H25 Cl N2 O2 | CC(C)c1ccc.... |
14 | 2BU5 | - | TF1 | C18 H20 F3 N3 O3 | C[C@H]1CN(.... |
15 | 2BU2 | - | TF1 | C18 H20 F3 N3 O3 | C[C@H]1CN(.... |
16 | 6LIL | - | EGX | C22 H19 N3 O2 | c1ccc2c(c1.... |
17 | 4MP7 | Kd = 1827 nM | PFT | C15 H13 N O3 | c1ccc2c(c1.... |
18 | 4MPC | Kd = 711 nM | PV2 | C14 H13 N O4 S | c1ccc2c(c1.... |
19 | 2Q8H | Ki = 1 mM | TF4 | C2 H2 Cl2 O2 | C(C(=O)O)(.... |
20 | 2Q8G | ic50 = 0.087 uM | AZX | C19 H18 Cl F3 N2 O5 S | C[C@@](C(=.... |
21 | 3D2R | Kd = 3.3 uM | ADP | C10 H15 N5 O10 P2 | c1nc(c2c(n.... |
22 | 2ZKJ | Kd = 3.3 uM | ADP | C10 H15 N5 O10 P2 | c1nc(c2c(n.... |
23 | 2ZDY | - | ADP | C10 H15 N5 O10 P2 | c1nc(c2c(n.... |
24 | 2E0A | - | ANP | C10 H17 N6 O12 P3 | c1nc(c2c(n.... |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | A06 | 0.9310 |
2 | PFT | 0.9191 |
3 | FUL 7KT | 0.9132 |
4 | TCT | 0.9065 |
5 | PV1 | 0.9009 |
6 | IXG | 0.8990 |
7 | IXE | 0.8971 |
8 | CHV | 0.8953 |
9 | RO3 | 0.8951 |
10 | 0SZ | 0.8918 |
11 | 5RX | 0.8916 |
12 | CHJ | 0.8915 |
13 | 5RW | 0.8908 |
14 | 9MK | 0.8901 |
15 | EXP | 0.8891 |
16 | IXF | 0.8880 |
17 | CWP | 0.8880 |
18 | ZW2 | 0.8868 |
19 | 9ME | 0.8859 |
20 | 1HX | 0.8836 |
21 | 7PS | 0.8835 |
22 | P9L | 0.8833 |
23 | M62 | 0.8822 |
24 | CMP | 0.8794 |
25 | 4YE | 0.8785 |
26 | 4KN | 0.8778 |
27 | 1EQ | 0.8762 |
28 | 0SL | 0.8762 |
29 | G50 | 0.8758 |
30 | BGK | 0.8721 |
31 | BFS | 0.8719 |
32 | L23 | 0.8710 |
33 | 9X0 | 0.8705 |
34 | 7VV | 0.8698 |
35 | 7NC | 0.8679 |
36 | 5R9 | 0.8672 |
37 | 5F7 | 0.8665 |
38 | 9RK | 0.8661 |
39 | WDX | 0.8657 |
40 | ACJ | 0.8652 |
41 | ZXG | 0.8643 |
42 | 4YF | 0.8641 |
43 | FL9 | 0.8637 |
44 | M03 | 0.8636 |
45 | L81 | 0.8537 |
46 | PCG | 0.8523 |
This union binding pocket(no: 1) in the query (biounit: 5j6a.bio1) has 37 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 5j6a.bio1) has 37 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |