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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 8 families. | |||||
1 | 1CSM | - | TRP | C11 H12 N2 O2 | c1ccc2c(c1.... |
2 | 5CSM | - | TRP | C11 H12 N2 O2 | c1ccc2c(c1.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 5 families. | |||||
1 | 1CSM | - | TRP | C11 H12 N2 O2 | c1ccc2c(c1.... |
2 | 5CSM | - | TRP | C11 H12 N2 O2 | c1ccc2c(c1.... |
3 | 5W6Y | - | TRP | C11 H12 N2 O2 | c1ccc2c(c1.... |
4 | 4PPU | - | TYR | C9 H11 N O3 | c1cc(ccc1C.... |
5 | 4PPV | - | PHE | C9 H11 N O2 | c1ccc(cc1).... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | DTR | 1 | 1 |
2 | TRP | 1 | 1 |
3 | LTN | 0.765957 | 0.777778 |
4 | 3IL | 0.666667 | 0.75 |
5 | TR7 | 0.666667 | 0.833333 |
6 | 4Z9 | 0.666667 | 0.75 |
7 | FT6 | 0.561404 | 0.888889 |
8 | IAC | 0.538462 | 0.787879 |
9 | TSR | 0.529412 | 0.722222 |
10 | IOP | 0.518519 | 0.764706 |
11 | R38 | 0.515152 | 0.72093 |
12 | R59 | 0.515152 | 0.72093 |
13 | ZIQ | 0.491525 | 0.864865 |
14 | 3IB | 0.491228 | 0.742857 |
15 | ITW | 0.491228 | 0.694444 |
16 | IAD | 0.484375 | 0.738095 |
17 | TRP GLY | 0.476923 | 0.704545 |
18 | TSS | 0.471698 | 0.666667 |
19 | CTE | 0.467742 | 0.888889 |
20 | DTE | 0.467742 | 0.888889 |
21 | IAV | 0.461538 | 0.738095 |
22 | IAG | 0.459016 | 0.738095 |
23 | LYS TRP | 0.432432 | 0.673913 |
24 | 78U | 0.42623 | 0.794118 |
25 | 0ZN | 0.421687 | 0.673913 |
26 | 4OG | 0.416667 | 0.8 |
27 | X95 | 0.411765 | 0.680851 |
28 | LSW | 0.411765 | 0.680851 |
29 | ASP TRP ASN | 0.405063 | 0.673913 |
30 | GLU ASP ASN ASP TRP ASN | 0.405063 | 0.673913 |
This union binding pocket(no: 1) in the query (biounit: 5csm.bio1) has 28 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 5csm.bio1) has 28 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |