- Navigate
- Expand All | Collapse All
- Receptor | Ligand | View in 3D
- Family: 90% | 70% | 50% | site
- External Links
- |
- Download
- Structure Biounit | Ligand Information
- PDB : .ZIP | .CSV
- Family 90% : .ZIP | .CSV
- Class : .ZIP | .CSV
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 2 families. | |||||
1 | 1MW3 | - | GLC FRU | n/a | n/a |
2 | 1MW2 | - | GLC FRU | n/a | n/a |
3 | 1MVY | - | GLC GLC GLC GLC | n/a | n/a |
4 | 4FLS | - | GLC FRU | n/a | n/a |
5 | 1MW0 | - | GLC GLC GLC GLC GLC GLC GLC | n/a | n/a |
6 | 1JGI | - | GLC FRU | n/a | n/a |
7 | 1ZS2 | - | GLC GLC GLC GLC | n/a | n/a |
8 | 1JG9 | - | GLC | C6 H12 O6 | C([C@@H]1[.... |
9 | 3UEQ | - | FRU GLC | n/a | n/a |
10 | 1MW1 | - | GLC FRU | n/a | n/a |
11 | 5N7J | - | GLC FRU | n/a | n/a |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 1 families. | |||||
1 | 1MW3 | - | GLC FRU | n/a | n/a |
2 | 1MW2 | - | GLC FRU | n/a | n/a |
3 | 1MVY | - | GLC GLC GLC GLC | n/a | n/a |
4 | 4FLS | - | GLC FRU | n/a | n/a |
5 | 1MW0 | - | GLC GLC GLC GLC GLC GLC GLC | n/a | n/a |
6 | 1JGI | - | GLC FRU | n/a | n/a |
7 | 1ZS2 | - | GLC GLC GLC GLC | n/a | n/a |
8 | 1JG9 | - | GLC | C6 H12 O6 | C([C@@H]1[.... |
9 | 3UEQ | - | FRU GLC | n/a | n/a |
10 | 1MW1 | - | GLC FRU | n/a | n/a |
11 | 5N7J | - | GLC FRU | n/a | n/a |
12 | 3CZG | - | GLC | C6 H12 O6 | C([C@@H]1[.... |
13 | 3CZL | - | GLC | C6 H12 O6 | C([C@@H]1[.... |
14 | 3UER | - | GLC FRU | n/a | n/a |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | GLC GLC GLC | 1 | 1 |
2 | BGC BGC GLC BGC XYS BGC XYS XYS | 0.690141 | 0.972222 |
3 | MAN BMA BMA | 0.65625 | 1 |
4 | BGC GLC GLC | 0.651515 | 0.942857 |
5 | BGC BGC BGC XYS XYS GAL | 0.6375 | 0.972222 |
6 | GLC GLC GLC GLC GLC | 0.614286 | 0.942857 |
7 | BGC GLC GLC GLC | 0.614286 | 0.942857 |
8 | MAN MAN BMA | 0.602941 | 1 |
9 | BGC BGC BGC BGC | 0.597222 | 0.942857 |
10 | BMA MAN MAN | 0.573529 | 0.942857 |
11 | BGC BGC XYS XYS GAL | 0.573171 | 0.944444 |
12 | BGC BGC BGC XYS XYS GAL GAL | 0.573171 | 0.944444 |
13 | BGC GLC GLC GLC GLC GLC | 0.571429 | 0.942857 |
14 | BGC GLC GLC GLC GLC | 0.571429 | 0.942857 |
15 | BGC BGC XYS GAL | 0.552632 | 0.944444 |
16 | GLC GLC XYS XYS | 0.547945 | 0.916667 |
17 | BGC BGC XYS BGC XYS XYS GAL | 0.546512 | 0.944444 |
18 | BGC BGC BGC XYS | 0.538462 | 0.944444 |
19 | BGC BGC BGC XYS BGC XYS XYS | 0.5375 | 0.944444 |
20 | BGC BGC BGC XYS BGC XYS XYS GAL GAL | 0.534091 | 0.944444 |
21 | BGC BGC BGC XYS BGC XYS XYS GAL | 0.534091 | 0.944444 |
22 | MMA MAN | 0.53125 | 0.891892 |
23 | BMA BMA BMA BMA GLA | 0.52 | 0.942857 |
24 | GLC AGL | 0.514706 | 0.755556 |
25 | MMA MAN MAN | 0.513889 | 0.891892 |
26 | BGC BGC BGC XYS BGC XYS | 0.506173 | 0.944444 |
27 | BGC BGC BGC BGC BGC XYS | 0.493976 | 0.944444 |
28 | BGC BGC BGC XYS BGC XYS BGC XYS BGC | 0.493976 | 0.944444 |
29 | BGC BGC BGC BGC XYS BGC XYS BGC BGC | 0.493976 | 0.944444 |
30 | BGC BGC BGC XYS BGC XYS GAL | 0.488636 | 0.944444 |
31 | AHR AHR AHR AHR AHR | 0.484375 | 0.810811 |
32 | AHR AHR AHR AHR | 0.484375 | 0.810811 |
33 | AHR AHR AHR AHR AHR AHR | 0.484375 | 0.810811 |
34 | GLC GLC GLC GLC GLC GLC GLC GLC GLC | 0.480519 | 0.942857 |
35 | MAN MAN MAN MAN MAN MAN MAN | 0.47619 | 0.942857 |
36 | H1M MAN MAN | 0.474359 | 0.871795 |
37 | NBG BGC BGC XYS BGC XYS XYS | 0.47191 | 0.708333 |
38 | BMA MAN MAN MAN | 0.4625 | 0.868421 |
39 | MAN MAN MAN | 0.4625 | 0.916667 |
40 | 1GN ACY GAL 1GN BGC ACY GAL BGC | 0.461538 | 0.66 |
41 | AHR AHR | 0.460317 | 0.810811 |
42 | G2F BGC BGC BGC BGC BGC | 0.453333 | 0.871795 |
43 | NAG BMA | 0.453333 | 0.693878 |
44 | NAG GAL BGC GAL | 0.440476 | 0.702128 |
45 | BMA MAN MAN MAN MAN | 0.440476 | 0.891892 |
46 | BMA NGT MAN MAN | 0.43956 | 0.634615 |
47 | BMA BMA BMA BMA GLA BMA GLA | 0.436782 | 0.868421 |
48 | GLC EDO GLC | 0.43662 | 0.944444 |
49 | FRU GLC GLA | 0.435897 | 0.846154 |
50 | NAG NAG BMA MAN MAN MAN MAN | 0.433962 | 0.673077 |
51 | NAG NAG MAN MAN MAN | 0.431579 | 0.66 |
52 | NOJ BGC | 0.430556 | 0.73913 |
53 | Z9N GLC | 0.430556 | 0.846154 |
54 | GLC FRU GLA GLA GLA | 0.43038 | 0.846154 |
55 | GLC FRU GLA GLA | 0.43038 | 0.846154 |
56 | QPU | 0.426829 | 0.772727 |
57 | IFM MAN | 0.424658 | 0.717391 |
58 | NAG BMA MAN MAN MAN MAN MAN MAN MAN | 0.418367 | 0.702128 |
59 | BGC GLA GAL | 0.41791 | 0.942857 |
60 | NGB | 0.414634 | 0.6 |
61 | GAL GLA | 0.411765 | 0.942857 |
62 | NOJ GLC | 0.410959 | 0.73913 |
63 | BGC BGC BGC BGC BGC BGC BGC BGC BGC | 0.408451 | 0.942857 |
64 | MAN BMA BMA BMA BMA BMA BMA | 0.408451 | 0.942857 |
65 | GLC GLC GLC GLC BGC GLC GLC | 0.408451 | 0.942857 |
66 | GLO BGC BGC XYS BGC XYS XYS | 0.408163 | 0.918919 |
67 | LSE | 0.407407 | 0.66 |
68 | BQZ | 0.40625 | 0.857143 |
69 | MAN MAN | 0.405797 | 0.942857 |
70 | GLC FRU GLA | 0.404762 | 0.846154 |
71 | BGC BGC BGC BGC BGC BGC | 0.402778 | 0.942857 |
72 | GLC BGC BGC BGC | 0.402778 | 0.942857 |
73 | BGC BGC BGC | 0.402778 | 0.942857 |
74 | BGC BGC BGC BGC BGC | 0.402778 | 0.942857 |
75 | BGC BGC BGC BGC BGC BGC BGC | 0.402778 | 0.942857 |
76 | 5QP | 0.402778 | 0.942857 |
77 | NAG BMA MAN MAN MAN MAN | 0.4 | 0.702128 |
78 | MGL GAL | 0.4 | 0.891892 |
79 | RZM | 0.4 | 0.695652 |
80 | GPM GLC | 0.4 | 0.733333 |
81 | BGC GAL GLA | 0.4 | 0.942857 |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | GLC GLC GLC GLC | 1 | 1 |
2 | GLC GLC GLC GLC GLC GLC GLC | 0.510638 | 0.939394 |
3 | GLC GLC GLC GLC GLC GLC | 0.510638 | 0.939394 |
4 | GLC GLC GLC GLC GLC GLC GLC GLC | 0.510638 | 0.939394 |
5 | 4PW | 0.5 | 0.777778 |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | GLC FRU | 1 | 1 |
2 | GLC FRU GLA | 0.761905 | 0.972973 |
3 | FRU GLC GLA | 0.5 | 0.921053 |
4 | GLC FRU GLA GLA GLA | 0.492958 | 0.921053 |
5 | GLC FRU GLA GLA | 0.492958 | 0.921053 |
6 | GLC FRU FRU FRU | 0.492958 | 0.921053 |
7 | ZEE UEA FRU FRU FRU | 0.492958 | 0.921053 |
8 | GLC FRU FRU | 0.457143 | 0.921053 |
9 | ARA TT7 4GL | 0.445783 | 0.744681 |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | LAG | 0.9370 |
2 | XYP GLC GLC | 0.9331 |
3 | GLC DAF | 0.9325 |
4 | GLC AC1 | 0.9214 |
5 | XYS GLC GLC | 0.9182 |
6 | LM2 | 0.9162 |
7 | SOR GLC GLC | 0.8879 |
8 | BMA BMA BMA | 0.8877 |
9 | GLC BGC BGC | 0.8707 |
10 | GAL GAL GAL | 0.8638 |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | BGC GLC GLC GLC | 0.9840 |
2 | GLC GLC AC1 | 0.9642 |
3 | GLC G6D ADH GLC | 0.9064 |
4 | GLC GAL GLD ACI | 0.9008 |
5 | GLC G6D ACI GLC | 0.8960 |
6 | BGC GLC AC1 | 0.8951 |
7 | GLC GLC DAF | 0.8904 |
8 | GLO GLC GLC GLC | 0.8881 |
9 | GLC GLC GLC BGC | 0.8817 |
10 | SOR GLC GLC GLC | 0.8761 |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | GLC Z9N | 0.9697 |
2 | MAN MAN | 0.9233 |
3 | FRU FRU | 0.9109 |
4 | MMA MAN | 0.9053 |
5 | RRY RRJ | 0.9023 |
6 | BDF GLC | 0.9009 |
7 | FRU GLC | 0.8988 |
8 | TW7 GLC | 0.8931 |
9 | GLC GLC | 0.8902 |
10 | GLA GLC | 0.8842 |
11 | ADA AQA | 0.8838 |
12 | GLC IFM | 0.8831 |
13 | 4UO | 0.8776 |
14 | GLC 7LQ | 0.8767 |
15 | GAL GLA | 0.8744 |
16 | ADA ADA | 0.8733 |
17 | GLC DMJ | 0.8705 |
18 | B1T | 0.8679 |
19 | 9E3 | 0.8670 |
20 | GLA GLA | 0.8647 |
21 | RR7 GLC | 0.8636 |
22 | 4P8 | 0.8619 |
23 | CQW | 0.8506 |
This union binding pocket(no: 1) in the query (biounit: 1jg9.bio1) has 18 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 1jg9.bio1) has 12 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 3) in the query (biounit: 1jg9.bio1) has 46 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
1 | 3GBE | NOJ | 15.7706 |
2 | 4HPH | GLC FRU | 16.1002 |
3 | 5DO8 | BGC | 16.5766 |
4 | 5DO8 | BGC | 16.5766 |
5 | 5DO8 | BGC | 16.5766 |
6 | 3WY2 | BGC | 17.1004 |
7 | 5WCZ | NOJ | 17.5768 |
8 | 5WCZ | NOJ | 17.5768 |
9 | 2ZID | GLC GLC GLC | 17.8637 |
10 | 2PWG | CTS | 39.2086 |