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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 2 families. | |||||
1 | 4AZ3 | ic50 = 0.005 uM | S35 | C26 H30 F N3 O5 | Cc1ccccc1[.... |
2 | 4AZ0 | ic50 = 0.038 uM | S61 | C20 H18 F N3 O4 | Cc1ccccc1[.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 2 families. | |||||
1 | 4AZ3 | ic50 = 0.005 uM | S35 | C26 H30 F N3 O5 | Cc1ccccc1[.... |
2 | 4AZ0 | ic50 = 0.038 uM | S61 | C20 H18 F N3 O4 | Cc1ccccc1[.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | S35 | 1 | 1 |
This union binding pocket(no: 1) in the query (biounit: 4az3.bio1) has 24 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
1 | 2ZU2 | DTZ | 3.22581 |
2 | 5EW9 | 5VC | 3.22581 |
3 | 3WCS | MAN NAG | 3.22581 |
4 | 5I34 | GDP | 3.33333 |
5 | 1WDN | GLN | 3.87097 |
6 | 2EUG | URA | 3.87097 |
7 | 2BD0 | BIO | 3.87097 |
8 | 4DID | GDP | 4.14508 |
9 | 5BVE | 4VG | 4.51613 |
10 | 2J0W | ASP | 4.51613 |
11 | 3CL7 | HYN | 4.51613 |
12 | 4UHF | BUA | 4.96454 |
13 | 4K91 | SIN | 5 |
14 | 6IS0 | M7G | 5 |
15 | 3THR | C2F | 5.16129 |
16 | 3CV2 | COA | 5.16129 |
17 | 3HPY | MCT | 5.16129 |
18 | 4D1J | DGJ | 5.16129 |
19 | 4FE2 | ASP | 5.16129 |
20 | 1UYY | BGC BGC | 5.34351 |
21 | 4GLW | NMN | 5.80645 |
22 | 2GU8 | 796 | 5.80645 |
23 | 1T0S | BML | 5.80645 |
24 | 3HQP | OXL | 5.80645 |
25 | 3HCH | RSM | 6.16438 |
26 | 3K0T | BGC | 6.29371 |
27 | 4XH0 | ADP | 6.33333 |
28 | 1GPE | FAD | 6.33333 |
29 | 2FCU | AKG | 6.45161 |
30 | 3MVH | WFE | 6.45161 |
31 | 1P9B | GDP | 6.45161 |
32 | 4OUJ | LBT | 6.66667 |
33 | 5JR6 | 01B PRO PRO ALA NH2 | 6.66667 |
34 | 2UYQ | SAM | 7 |
35 | 1C3X | 8IG | 7.09677 |
36 | 5X7Q | GLC GLC GLC | 7.09677 |
37 | 5D63 | FUC GLA GLA | 7.09677 |
38 | 5X7Q | GLC GLC GLC GLC | 7.09677 |
39 | 2CUN | 3PG | 7.09677 |
40 | 3O8M | BGC | 7.33333 |
41 | 3O8M | GLC | 7.33333 |
42 | 1DZT | TPE | 7.65027 |
43 | 4LS3 | HIS | 7.74194 |
44 | 1RJW | ETF | 7.74194 |
45 | 1NJJ | GET | 7.74194 |
46 | 4UYF | 73B | 8.44156 |
47 | 6FGL | UO1 | 8.57143 |
48 | 4JOB | TLA | 9 |
49 | 2YKX | AKG | 9.03226 |
50 | 4HNN | LYS | 9.03226 |
51 | 5M8T | 0TR | 9.03226 |
52 | 2C6Q | NDP | 9.03226 |
53 | 2A1X | AKG | 9.67742 |
54 | 5FPE | 3TR | 9.67742 |
55 | 1RLJ | FMN | 10.0719 |
56 | 5K1F | IMP | 10.3226 |
57 | 3F7Z | 34O | 10.3226 |
58 | 4TVD | BGC | 10.3226 |
59 | 4KBA | 1QM | 10.9677 |
60 | 3VSV | XYS | 10.9677 |
61 | 2EAE | FUL | 10.9677 |
62 | 1ON3 | DXX | 10.9677 |
63 | 4L9I | 8PR | 11 |
64 | 6IKG | MET ALA ALA | 11.6129 |
65 | 1TDF | FAD | 11.6129 |
66 | 5G48 | 1FL | 11.6129 |
67 | 3V8S | 0HD | 11.6667 |
68 | 1Q19 | SSC | 13 |
69 | 2JK0 | ASP | 13.5484 |
70 | 5DEY | 59T | 15.4839 |
71 | 3IT1 | TLA | 16.129 |
72 | 5EPA | AKG | 16.8459 |
73 | 4FBL | SPD | 17.0819 |
74 | 4G86 | BNT | 17.4194 |
75 | 5Z84 | PEK | 17.8571 |
76 | 2I7C | AAT | 19.3548 |
77 | 1XRO | LEU | 23.2082 |
78 | 5OFI | 9TQ | 23.7705 |
79 | 3G2Y | GF4 | 27.7419 |
80 | 5LVP | ATP | 33.3333 |