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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 | 6MA8 | Kd = 2650 uM | PMF | C7 H7 F O2 S | c1ccc(cc1).... |
2 | 4D6Z | - | PK9 | C17 H27 N3 O3 | CC(C)(C)OC.... |
3 | 5VCE | - | RIT | C37 H48 N6 O5 S2 | CC(C)c1nc(.... |
4 | 3UA1 | Kd = 0.37 uM | 08Y | C32 H40 Br N5 O5 | CC(C)C[C@H.... |
5 | 6DAB | Kd = 0.042 uM | G0V | C30 H37 N3 O3 S | CC(C)(C)OC.... |
6 | 6UNG | ic50 = 0.055 uM | QEP | C33 H38 N4 O3 S | CC(C)(C)OC.... |
7 | 6MA6 | Kd = 2.4 uM | MYT | C14 H14 N2 O | CC(C)(c1cc.... |
8 | 6OOB | - | MWS | C21 H24 O6 | C/C(=C/COc.... |
9 | 6DAJ | Kd = 0.055 uM | FZV | C30 H37 N3 O3 S | CC(C)(C)OC.... |
10 | 4K9T | ic50 = 15 uM | 1RD | C23 H36 N6 O4 S2 | CC(C)c1nc(.... |
11 | 4K9W | ic50 = 2.8 uM | 7AW | C33 H48 N6 O4 S2 | CCC[C@@H](.... |
12 | 6DA5 | Kd = 0.07 uM | G1J | C29 H35 N3 O3 S | CC(C)(C)OC.... |
13 | 6OO9 | - | MWV | C29 H38 F N3 O3 | CC(C)[C@H].... |
14 | 5A1R | - | STR | C21 H30 O2 | CC(=O)[C@H.... |
15 | 6MA7 | Kd = 17 uM | TPF | C13 H12 F2 N6 O | c1cc(c(cc1.... |
16 | 5A1P | - | CIT | C6 H8 O7 | C(C(=O)O)C.... |
17 | 6DA3 | Kd = 0.063 uM | G0D | C29 H35 N3 O3 S | CC(C)(C)OC.... |
18 | 3NXU | - | RIT | C37 H48 N6 O5 S2 | CC(C)c1nc(.... |
19 | 4D75 | Kd = 105 uM | PK9 | C17 H27 N3 O3 | CC(C)(C)OC.... |
20 | 6DAA | Kd = 0.042 uM | G0M | C29 H35 N3 O3 S | CC(C)(C)OC.... |
21 | 5VCG | - | 08Y | C32 H40 Br N5 O5 | CC(C)C[C@H.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 1 families. | |||||
1 | 6MA8 | Kd = 2650 uM | PMF | C7 H7 F O2 S | c1ccc(cc1).... |
2 | 4D6Z | - | PK9 | C17 H27 N3 O3 | CC(C)(C)OC.... |
3 | 5VCE | - | RIT | C37 H48 N6 O5 S2 | CC(C)c1nc(.... |
4 | 3UA1 | Kd = 0.37 uM | 08Y | C32 H40 Br N5 O5 | CC(C)C[C@H.... |
5 | 6DAB | Kd = 0.042 uM | G0V | C30 H37 N3 O3 S | CC(C)(C)OC.... |
6 | 6UNG | ic50 = 0.055 uM | QEP | C33 H38 N4 O3 S | CC(C)(C)OC.... |
7 | 6MA6 | Kd = 2.4 uM | MYT | C14 H14 N2 O | CC(C)(c1cc.... |
8 | 6OOB | - | MWS | C21 H24 O6 | C/C(=C/COc.... |
9 | 6DAJ | Kd = 0.055 uM | FZV | C30 H37 N3 O3 S | CC(C)(C)OC.... |
10 | 4K9T | ic50 = 15 uM | 1RD | C23 H36 N6 O4 S2 | CC(C)c1nc(.... |
11 | 4K9W | ic50 = 2.8 uM | 7AW | C33 H48 N6 O4 S2 | CCC[C@@H](.... |
12 | 6DA5 | Kd = 0.07 uM | G1J | C29 H35 N3 O3 S | CC(C)(C)OC.... |
13 | 6OO9 | - | MWV | C29 H38 F N3 O3 | CC(C)[C@H].... |
14 | 5A1R | - | STR | C21 H30 O2 | CC(=O)[C@H.... |
15 | 6MA7 | Kd = 17 uM | TPF | C13 H12 F2 N6 O | c1cc(c(cc1.... |
16 | 5A1P | - | CIT | C6 H8 O7 | C(C(=O)O)C.... |
17 | 6DA3 | Kd = 0.063 uM | G0D | C29 H35 N3 O3 S | CC(C)(C)OC.... |
18 | 3NXU | - | RIT | C37 H48 N6 O5 S2 | CC(C)c1nc(.... |
19 | 4D75 | Kd = 105 uM | PK9 | C17 H27 N3 O3 | CC(C)(C)OC.... |
20 | 6DAA | Kd = 0.042 uM | G0M | C29 H35 N3 O3 S | CC(C)(C)OC.... |
21 | 5VCG | - | 08Y | C32 H40 Br N5 O5 | CC(C)C[C@H.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | MWS | 1 | 1 |
No: | Ligand | Similarity coefficient |
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This union binding pocket(no: 1) in the query (biounit: 6daa.bio1) has 44 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |