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- 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 4 families. | |||||
1 | 2HK1 | - | FUD | C6 H12 O6 | C([C@H]([C.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 3 families. | |||||
1 | 2HK1 | - | FUD | C6 H12 O6 | C([C@H]([C.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | SDD | 1 | 1 |
2 | PSJ | 1 | 1 |
3 | FUD | 1 | 1 |
4 | SOL | 1 | 1 |
5 | LPK | 1 | 1 |
6 | TAG | 1 | 1 |
7 | QDK | 0.551724 | 0.956522 |
8 | RBL | 0.551724 | 0.956522 |
9 | XUL | 0.551724 | 0.956522 |
10 | F6R | 0.5 | 0.628571 |
11 | TG6 | 0.5 | 0.628571 |
12 | 3MF | 0.432432 | 0.846154 |
13 | 5FX | 0.424242 | 0.88 |
14 | LER | 0.413793 | 0.956522 |
15 | GCO | 0.411765 | 0.913043 |
16 | CS2 | 0.411765 | 0.913043 |
17 | I22 | 0.404762 | 0.628571 |
This union binding pocket(no: 1) in the query (biounit: 2hk1.bio1) has 15 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
1 | 4EI7 | GDP | 1.94175 |
2 | 2RHW | C0E | 2.12014 |
3 | 2GYI | HYA | 2.26537 |
4 | 3GGO | ENO | 2.26537 |
5 | 3GGO | NAI | 2.26537 |
6 | 3GMB | FAD | 2.26537 |
7 | 2HSA | FMN | 2.26537 |
8 | 3ATY | FMN | 2.589 |
9 | 1ME8 | RVP | 2.91262 |
10 | 1XIM | XYL | 2.91262 |
11 | 1XPK | HMG | 2.91262 |
12 | 2BLE | 5GP | 2.91262 |
13 | 4A8T | PAO | 2.94985 |
14 | 1DE6 | RNS | 3.23625 |
15 | 2J5V | PCA | 3.23625 |
16 | 1DUV | PSQ | 3.23625 |
17 | 1IOW | ADP | 3.26797 |
18 | 1IOW | PHY | 3.26797 |
19 | 1OF8 | G3P | 3.55987 |
20 | 1OF8 | PEP | 3.55987 |
21 | 3GD8 | GOL | 3.58744 |
22 | 1PVN | MZP | 3.8835 |
23 | 2I56 | RNS | 3.8835 |
24 | 2BEK | ATP | 4.28016 |
25 | 2TPS | TPS | 4.40529 |
26 | 5ABF | XRJ | 4.53074 |
27 | 3OVR | 5SP | 4.82456 |
28 | 3H78 | BE2 | 4.85437 |
29 | 6HL7 | CP | 5.17799 |
30 | 2ZUX | RAM | 5.50162 |
31 | 5XVR | TRH | 6.47249 |
32 | 3EPO | MP5 | 7.11974 |
33 | 1VYP | FMN | 7.76699 |
34 | 1VYP | TNF | 7.76699 |
35 | 5KGS | 6SR | 8.09062 |
36 | 2WYA | HMG | 8.09062 |
37 | 1XLI | GLT | 8.73786 |
38 | 3DX5 | DHB | 8.74126 |
39 | 3ZRR | PXG | 9.06149 |
40 | 1EP2 | FMN | 9.70874 |
41 | 3TFC | PEP | 11.4286 |
42 | 5H1W | LER | 18.9655 |
This union binding pocket(no: 3) in the query (biounit: 2hk1.bio1) has 14 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
1 | 5MPT | SAH | 0.970874 |
2 | 1XSE | NDP | 2.0339 |
3 | 4JB0 | ENO | 2.589 |
4 | 3K5I | ADP | 2.91262 |
5 | 4X3R | 686 | 3.23625 |
6 | 4UFH | GIF | 3.23625 |
7 | 4O9S | 2RY | 3.25581 |
8 | 4LZJ | 22H | 3.30033 |
9 | 4UTU | LRY | 3.49345 |
10 | 4UTW | RFW | 3.49345 |
11 | 6FU4 | HSM | 3.55987 |
12 | 1TXR | BES | 4.01338 |
13 | 3N7O | N7O | 4.42478 |
14 | 3ZS9 | ADP ALF | 4.53074 |
15 | 1ICP | FMN | 4.53074 |
16 | 4OOE | NDP | 4.70297 |
17 | 4OOE | FOM | 4.70297 |
18 | 4A3U | FMN | 4.85437 |
19 | 1JV1 | UD1 | 5.50162 |
20 | 4K2G | 1OQ | 6.14887 |
21 | 4NG2 | OHN | 6.19469 |
22 | 5NH6 | XYL | 6.47249 |
23 | 5BQS | 4VN | 6.47249 |
24 | 2Q3R | FMN | 7.44337 |
25 | 3KRU | FMN | 7.76699 |