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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 1 families. | |||||
1 | 4LFM | - | PSJ | C6 H12 O6 | C([C@H]([C.... |
2 | 4LFN | - | RBL | C5 H10 O5 | C([C@H]([C.... |
3 | 4LFL | - | TG6 | C6 H13 O9 P | C([C@H]([C.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 1 families. | |||||
1 | 4LFM | - | PSJ | C6 H12 O6 | C([C@H]([C.... |
2 | 4LFN | - | RBL | C5 H10 O5 | C([C@H]([C.... |
3 | 4LFL | - | TG6 | C6 H13 O9 P | C([C@H]([C.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | F6R | 1 | 1 |
2 | TG6 | 1 | 1 |
3 | I22 | 0.74359 | 1 |
4 | P6T | 0.7 | 0.971429 |
5 | 2FP | 0.7 | 0.971429 |
6 | P6F | 0.7 | 0.971429 |
7 | 5SP | 0.641026 | 0.972222 |
8 | 5RP | 0.641026 | 0.972222 |
9 | R10 | 0.641026 | 0.916667 |
10 | HMS | 0.641026 | 0.972222 |
11 | PA5 | 0.641026 | 0.916667 |
12 | PAN | 0.581395 | 0.6875 |
13 | 9C2 | 0.568182 | 0.673469 |
14 | M2P | 0.555556 | 0.942857 |
15 | GOS | 0.555556 | 0.942857 |
16 | LG6 | 0.534884 | 0.916667 |
17 | 6PG | 0.534884 | 0.916667 |
18 | O1B | 0.530612 | 0.7 |
19 | SDD | 0.5 | 0.628571 |
20 | DX5 | 0.5 | 0.916667 |
21 | LPK | 0.5 | 0.628571 |
22 | A5P | 0.5 | 0.916667 |
23 | LX1 | 0.5 | 0.837838 |
24 | PSJ | 0.5 | 0.628571 |
25 | LXP | 0.5 | 0.916667 |
26 | KD0 | 0.5 | 0.916667 |
27 | TAG | 0.5 | 0.628571 |
28 | FUD | 0.5 | 0.628571 |
29 | SOL | 0.5 | 0.628571 |
30 | S6P | 0.487805 | 0.942857 |
31 | DER | 0.487805 | 0.916667 |
32 | DEZ | 0.487805 | 0.916667 |
33 | RUB | 0.477273 | 0.916667 |
34 | XBP | 0.477273 | 0.916667 |
35 | DXP | 0.47619 | 0.837838 |
36 | R52 | 0.465116 | 0.942857 |
37 | DG6 | 0.465116 | 0.891892 |
38 | R5P | 0.465116 | 0.942857 |
39 | TX4 | 0.465116 | 0.645833 |
40 | HG3 | 0.459459 | 0.805556 |
41 | 52L | 0.44898 | 0.702128 |
42 | RES | 0.444444 | 0.6875 |
43 | AGP | 0.444444 | 0.767442 |
44 | G6Q | 0.444444 | 0.942857 |
45 | M6R | 0.444444 | 0.767442 |
46 | 4TP | 0.431818 | 0.767442 |
47 | FQ8 | 0.425532 | 0.944444 |
48 | LRY | 0.423077 | 0.733333 |
49 | H4P | 0.42 | 0.790698 |
50 | 1NT | 0.407407 | 0.916667 |
51 | E4P | 0.404762 | 0.885714 |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | 2OR | 0.8829 |
2 | 4AF | 0.8810 |
3 | EPE | 0.8763 |
4 | JPQ | 0.8749 |
5 | IS2 | 0.8717 |
6 | 8V8 | 0.8677 |
7 | RYY | 0.8673 |
8 | STV | 0.8663 |
9 | PMV | 0.8642 |
10 | IJ1 | 0.8641 |
11 | 8EU | 0.8641 |
12 | RYV | 0.8636 |
13 | 0V7 | 0.8633 |
14 | JON | 0.8611 |
15 | TID | 0.8582 |
16 | NAL | 0.8565 |
17 | FMQ | 0.8564 |
18 | BTN | 0.8555 |
19 | HSA | 0.8544 |
20 | 7N8 | 0.8537 |
21 | 4FE | 0.8533 |
This union binding pocket(no: 2) in the query (biounit: 4lfl.bio1) has 16 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 3) in the query (biounit: 4lfl.bio1) has 16 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
1 | 2BES | RES | 43.8272 |
2 | 2BES | RES | 43.8272 |
This union binding pocket(no: 4) in the query (biounit: 4lfl.bio1) has 16 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |