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- Structure Biounit | Ligand Information
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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 261 families. | |||||
1 | 6PHT | ic50 = 390 uM | OKP | C8 H21 B N2 O2 | B(CCCCCNCC.... |
2 | 6PIC | ic50 = 410 uM | 6XA | C6 H14 N2 O2 | C(CCC(=O)N.... |
3 | 6PIA | ic50 = 550 uM | XS6 | C9 H21 N3 O2 | C(CCC(=O)N.... |
4 | 6PID | ic50 = 380 uM | OKS | C8 H18 N2 O2 | C(CCCC(=O).... |
5 | 6PI1 | ic50 = 160 uM | B3N | C16 H25 N3 O3 | CN(C)c1ccc.... |
6 | 6PHZ | ic50 = 350 uM | FKS | C10 H21 F3 N2 O2 | C(CCC(C(F).... |
7 | 6PHR | ic50 = 160 uM | SS9 | C8 H20 N2 S | C(CCNCCCN).... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 214 families. | |||||
1 | 6PHT | ic50 = 390 uM | OKP | C8 H21 B N2 O2 | B(CCCCCNCC.... |
2 | 6PIC | ic50 = 410 uM | 6XA | C6 H14 N2 O2 | C(CCC(=O)N.... |
3 | 6PIA | ic50 = 550 uM | XS6 | C9 H21 N3 O2 | C(CCC(=O)N.... |
4 | 6PID | ic50 = 380 uM | OKS | C8 H18 N2 O2 | C(CCCC(=O).... |
5 | 6PI1 | ic50 = 160 uM | B3N | C16 H25 N3 O3 | CN(C)c1ccc.... |
6 | 6PHZ | ic50 = 350 uM | FKS | C10 H21 F3 N2 O2 | C(CCC(C(F).... |
7 | 6PHR | ic50 = 160 uM | SS9 | C8 H20 N2 S | C(CCNCCCN).... |
8 | 3Q9C | - | Q9C | C9 H21 N3 O | CC(=O)NCCC.... |
9 | 4ZUN | ic50 = 26 uM | SS9 | C8 H20 N2 S | C(CCNCCCN).... |
10 | 4ZUM | - | FKS | C10 H21 F3 N2 O2 | C(CCC(C(F).... |
11 | 3Q9B | - | B3N | C16 H25 N3 O3 | CN(C)c1ccc.... |
12 | 4ZUQ | ic50 = 0.13 uM | 6XA | C6 H14 N2 O2 | C(CCC(=O)N.... |
13 | 4ZUP | ic50 = 0.17 uM | 5XA | C5 H12 N2 O2 | C(CCN)CC(=.... |
14 | 3Q9E | - | SP5 | C12 H28 N4 O | CC(=O)NCCC.... |
15 | 4ZUO | ic50 = 0.39 uM | XS6 | C9 H21 N3 O2 | C(CCC(=O)N.... |
16 | 4ZUR | ic50 = 0.068 uM | 7XA | C7 H16 N2 O2 | C(CCCN)CCC.... |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | Q9C | 0.9390 |
2 | DKA | 0.9363 |
3 | GC7 | 0.9159 |
4 | 9OD | 0.9150 |
5 | 9J6 | 0.9137 |
6 | 5UF | 0.9112 |
7 | 8AC | 0.9079 |
8 | M12 | 0.9075 |
9 | HZZ | 0.9065 |
10 | ALY | 0.9058 |
11 | 4DI | 0.9035 |
12 | KNA | 0.9006 |
13 | DE1 | 0.8985 |
14 | KAP | 0.8974 |
15 | OKS | 0.8938 |
16 | U4G | 0.8915 |
17 | D10 | 0.8897 |
18 | N8C | 0.8896 |
19 | DIA | 0.8890 |
20 | DA2 | 0.8879 |
21 | 3KJ | 0.8871 |
22 | HAR | 0.8865 |
23 | ZE7 | 0.8842 |
24 | PML | 0.8828 |
25 | BZM | 0.8801 |
26 | AZ1 | 0.8771 |
27 | 58X | 0.8731 |
28 | WT2 | 0.8721 |
29 | VIO | 0.8719 |
30 | NRG | 0.8715 |
31 | 4JK | 0.8711 |
32 | 5TO | 0.8690 |
33 | ARG | 0.8674 |
34 | JM2 | 0.8657 |
35 | M3L | 0.8656 |
36 | DTB | 0.8634 |
37 | DMA | 0.8625 |
38 | GLY GLY GLY | 0.8616 |
39 | 1KJ | 0.8590 |
40 | DST | 0.8581 |
41 | D9L | 0.8560 |
42 | BOW | 0.8535 |
This union binding pocket(no: 1) in the query (biounit: 6phr.bio1) has 58 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 6phr.bio1) has 58 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |