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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 20 families. | |||||
1 | 2R6R | - | GDP | C10 H15 N5 O11 P2 | c1nc2c(n1[.... |
2 | 2R75 | Kd = 714 nM | 01G | C14 H23 N6 O15 P3 | C1COCCN1c2.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 14 families. | |||||
1 | 4DXD | - | GDP | C10 H15 N5 O11 P2 | c1nc2c(n1[.... |
2 | 3WGM | - | GTP | C10 H16 N5 O14 P3 | c1nc2c(n1[.... |
3 | 2RHL | - | GDP | C10 H15 N5 O11 P2 | c1nc2c(n1[.... |
4 | 2RHO | - | GSP | C10 H16 N5 O13 P3 S | c1nc2c(n1[.... |
5 | 5XDV | - | GDP | C10 H15 N5 O11 P2 | c1nc2c(n1[.... |
6 | 5XDT | - | MB3 | C5 H9 N O | CN1CCCC1=O |
7 | 6RVQ | - | GDP | C10 H15 N5 O11 P2 | c1nc2c(n1[.... |
8 | 6SI9 | Kd = 18.2 nM | GDP | C10 H15 N5 O11 P2 | c1nc2c(n1[.... |
9 | 6RVP | - | GDP | C10 H15 N5 O11 P2 | c1nc2c(n1[.... |
10 | 5H5G | - | GDP | C10 H15 N5 O11 P2 | c1nc2c(n1[.... |
11 | 6RVN | Kd = 18.2 nM | GDP | C10 H15 N5 O11 P2 | c1nc2c(n1[.... |
12 | 6KVP | - | GDP | C10 H15 N5 O11 P2 | c1nc2c(n1[.... |
13 | 5H5H | - | GDP | C10 H15 N5 O11 P2 | c1nc2c(n1[.... |
14 | 5H5I | - | GDP | C10 H15 N5 O11 P2 | c1nc2c(n1[.... |
15 | 6KVQ | Kd = 0.88 uM | DVX | C33 H25 B Br F7 N4 O5 | [B-]1(n2c(.... |
16 | 5XDW | - | GDP | C10 H15 N5 O11 P2 | c1nc2c(n1[.... |
17 | 5MN4 | - | GDP | C10 H15 N5 O11 P2 | c1nc2c(n1[.... |
18 | 5XDU | - | GDP | C10 H15 N5 O11 P2 | c1nc2c(n1[.... |
19 | 1W5F | - | G2P | C11 H18 N5 O13 P3 | c1nc2c(n1[.... |
20 | 1RQ2 | ic50 = 3 mM | CIT | C6 H8 O7 | C(C(=O)O)C.... |
21 | 1RLU | - | GSP | C10 H16 N5 O13 P3 S | c1nc2c(n1[.... |
22 | 1W5B | - | GTP | C10 H16 N5 O14 P3 | c1nc2c(n1[.... |
23 | 1W5A | - | GTP | C10 H16 N5 O14 P3 | c1nc2c(n1[.... |
24 | 1W58 | - | G2P | C11 H18 N5 O13 P3 | c1nc2c(n1[.... |
25 | 2VAP | - | GDP | C10 H15 N5 O11 P2 | c1nc2c(n1[.... |
26 | 6LL5 | - | GDP | C10 H15 N5 O11 P2 | c1nc2c(n1[.... |
27 | 6LL6 | - | GDP | C10 H15 N5 O11 P2 | c1nc2c(n1[.... |
28 | 6UMK | - | GDP | C10 H15 N5 O11 P2 | c1nc2c(n1[.... |
29 | 6UNX | - | GTP | C10 H16 N5 O14 P3 | c1nc2c(n1[.... |
30 | 2R6R | - | GDP | C10 H15 N5 O11 P2 | c1nc2c(n1[.... |
31 | 2R75 | Kd = 714 nM | 01G | C14 H23 N6 O15 P3 | C1COCCN1c2.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | 01G | 1 | 1 |
2 | GTP | 0.518868 | 0.902439 |
3 | QBQ | 0.5 | 0.890244 |
4 | MGP | 0.495327 | 0.870588 |
5 | 6G0 | 0.490741 | 0.870588 |
6 | GP3 | 0.46729 | 0.903614 |
7 | GDP | 0.462963 | 0.902439 |
8 | GSP | 0.442478 | 0.860465 |
9 | G1R | 0.433628 | 0.891566 |
10 | MGT | 0.433628 | 0.791209 |
11 | DGT | 0.433628 | 0.903614 |
12 | 0O2 | 0.432203 | 0.890244 |
13 | 8GT | 0.423423 | 0.795455 |
14 | GAV | 0.422414 | 0.870588 |
15 | GNH | 0.419643 | 0.891566 |
16 | GNP | 0.417391 | 0.880952 |
17 | 9GM | 0.417391 | 0.880952 |
18 | GTG | 0.414634 | 0.872093 |
19 | GH3 | 0.413793 | 0.879518 |
20 | GPD | 0.412698 | 0.883721 |
21 | G2R | 0.411765 | 0.915663 |
22 | GCP | 0.408696 | 0.880952 |
23 | G5P | 0.408 | 0.903614 |
24 | CAG | 0.407407 | 0.824176 |
25 | GDC | 0.406504 | 0.892857 |
26 | GDD | 0.406504 | 0.892857 |
27 | GKE | 0.406504 | 0.892857 |
28 | GDR | 0.403226 | 0.892857 |
29 | GFB | 0.403226 | 0.892857 |
30 | JSQ | 0.401786 | 0.793103 |
31 | HFD | 0.401786 | 0.793103 |
32 | G3A | 0.4 | 0.903614 |
33 | MGO | 0.4 | 0.786517 |
34 | 6CK | 0.4 | 0.872093 |
No: | Ligand | Similarity coefficient |
---|
This union binding pocket(no: 1) in the query (biounit: 2r75.bio1) has 29 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |