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No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 5 families. | |||||
1 | 3N87 | Ki = 11 uM | N87 | C20 H18 O6 | c1ccc(cc1).... |
2 | 2Y76 | Ki = 440 nM | CB7 | C25 H22 O6 S2 | c1cc2c(ccs.... |
3 | 3N7A | Ki = 200 uM | FA1 | C7 H10 O5 | C1[C@H]([C.... |
4 | 4B6O | Ki = 100 nM | 3DQ | C15 H18 O7 | COc1ccc(cc.... |
5 | 2Y71 | Ki = 42.5 nM | CB6 | C17 H18 O6 S | Cc1ccc2c(c.... |
6 | 4CIW | Ki = 15 uM | XH2 | C9 H14 O6 | C1[C@H]([C.... |
7 | 4B6P | Ki = 74 nM | 2HN | C14 H11 F5 O6 | C1[C@H]([C.... |
8 | 3N8N | Ki = 27 uM | N88 | C12 H19 N O6 | CC(C)(C)NC.... |
9 | 3N76 | Ki = 0.14 uM | CA2 | C16 H22 O6 | c1ccc(cc1).... |
10 | 4CIY | Ki = 27 uM | NDY | C15 H18 O6 | c1ccc(cc1).... |
11 | 1H0R | Ki = 200 uM | FA1 | C7 H10 O5 | C1[C@H]([C.... |
12 | 3N86 | Ki = 2.3 uM | RJP | C16 H17 N O6 | c1ccc(cc1).... |
13 | 2XB8 | Ki = 26 nM | XNW | C15 H18 O7 | COc1ccc(cc.... |
14 | 1H0S | - | FA6 | C7 H11 N O6 | C1[C@H]([C.... |
15 | 4B6Q | Ki = 28 nM | BZ5 | C16 H16 O6 S | c1cc2c(ccs.... |
16 | 2Y77 | Ki = 250 nM | CB8 | C21 H20 O6 S2 | c1ccc2c(c1.... |
17 | 3N8K | Kd = 90 uM | D1X | C6 H5 N O4 | C1C(=CC(=O.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 4 families. | |||||
1 | 3N87 | Ki = 11 uM | N87 | C20 H18 O6 | c1ccc(cc1).... |
2 | 2Y76 | Ki = 440 nM | CB7 | C25 H22 O6 S2 | c1cc2c(ccs.... |
3 | 3N7A | Ki = 200 uM | FA1 | C7 H10 O5 | C1[C@H]([C.... |
4 | 4B6O | Ki = 100 nM | 3DQ | C15 H18 O7 | COc1ccc(cc.... |
5 | 2Y71 | Ki = 42.5 nM | CB6 | C17 H18 O6 S | Cc1ccc2c(c.... |
6 | 4CIW | Ki = 15 uM | XH2 | C9 H14 O6 | C1[C@H]([C.... |
7 | 4B6P | Ki = 74 nM | 2HN | C14 H11 F5 O6 | C1[C@H]([C.... |
8 | 3N8N | Ki = 27 uM | N88 | C12 H19 N O6 | CC(C)(C)NC.... |
9 | 1GTZ | - | DHK | C7 H10 O5 | C1[C@@H](C.... |
10 | 3N8K | Kd = 90 uM | D1X | C6 H5 N O4 | C1C(=CC(=O.... |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | CBF | 0.9443 |
2 | FA6 | 0.9267 |
3 | KDO | 0.9235 |
4 | DQA | 0.9150 |
5 | CRB | 0.9149 |
6 | DNC | 0.9116 |
7 | 4XY | 0.9058 |
8 | 7WR | 0.9038 |
9 | XD9 | 0.9033 |
10 | 8VN | 0.8996 |
11 | 1N4 | 0.8985 |
12 | MBG | 0.8940 |
13 | N88 | 0.8929 |
14 | 3MG | 0.8922 |
15 | IPT | 0.8914 |
16 | MAN | 0.8905 |
17 | 1X7 | 0.8899 |
18 | 8VE | 0.8891 |
19 | KDM | 0.8881 |
20 | AMG | 0.8879 |
21 | GLS | 0.8873 |
22 | JKZ | 0.8871 |
23 | MIF | 0.8859 |
24 | SBI | 0.8852 |
25 | GL4 | 0.8849 |
26 | FXH | 0.8844 |
27 | FHN | 0.8841 |
28 | 4AV | 0.8831 |
29 | FWB | 0.8823 |
30 | XQK | 0.8817 |
31 | BK9 | 0.8817 |
32 | TQU | 0.8805 |
33 | CKU | 0.8801 |
34 | NLA | 0.8801 |
35 | ICT | 0.8797 |
36 | VNL | 0.8797 |
37 | K3Q | 0.8763 |
38 | PRZ | 0.8761 |
39 | DHK | 0.8760 |
40 | OKM | 0.8756 |
41 | I6G | 0.8753 |
42 | II6 | 0.8749 |
43 | AED | 0.8746 |
44 | 5OF | 0.8744 |
45 | 3R9 | 0.8734 |
46 | MYI | 0.8732 |
47 | CIT | 0.8719 |
48 | SRO | 0.8714 |
49 | 1U1 | 0.8714 |
50 | SYR | 0.8701 |
51 | SF9 | 0.8684 |
52 | YIO | 0.8680 |
53 | AIN | 0.8670 |
54 | IBM | 0.8660 |
55 | FLC | 0.8659 |
56 | 60Q | 0.8655 |
57 | 1AL | 0.8651 |
58 | GL1 | 0.8646 |
59 | CGF | 0.8641 |
60 | BMA | 0.8637 |
61 | 692 | 0.8635 |
62 | GOX | 0.8631 |
63 | A9O | 0.8631 |
64 | ALA LEU | 0.8631 |
65 | NBG | 0.8628 |
66 | F69 | 0.8621 |
67 | GYP | 0.8619 |
68 | PCV | 0.8619 |
69 | P20 | 0.8587 |
70 | FA1 | 0.8571 |
71 | 3CU | 0.8564 |
72 | HPT | 0.8558 |
73 | CKX | 0.8526 |
74 | HCA | 0.8515 |
This union binding pocket(no: 1) in the query (biounit: 2xb8.bio1) has 48 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 2xb8.bio1) has 48 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 3) in the query (biounit: 2xb8.bio1) has 48 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 4) in the query (biounit: 2xb8.bio1) has 48 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 5) in the query (biounit: 2xb8.bio1) has 48 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 6) in the query (biounit: 2xb8.bio1) has 48 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 7) in the query (biounit: 2xb8.bio1) has 48 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 8) in the query (biounit: 2xb8.bio1) has 48 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 9) in the query (biounit: 2xb8.bio1) has 48 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 10) in the query (biounit: 2xb8.bio1) has 48 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 11) in the query (biounit: 2xb8.bio1) has 48 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 12) in the query (biounit: 2xb8.bio1) has 48 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |