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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 426 families. | |||||
1 | 1ZHW | - | HC2 | C27 H46 O2 | CC(C)CCC[C.... |
2 | 1ZHY | Kd = 300 nM | CLR | C27 H46 O | CC(C)CCC[C.... |
3 | 1ZHT | - | HCR | C27 H46 O2 | C[C@H](CCC.... |
4 | 4F4B | - | L39 | C27 H41 I O3 | C[C@H](CCC.... |
5 | 1ZHX | Kd = 55 nM | HC3 | C27 H46 O2 | C[C@H](CCC.... |
6 | 4FES | - | 0T9 | C28 H44 O3 | CC[C@H](C).... |
7 | 1ZHZ | - | ERG | C28 H44 O | CC(C)[C@@H.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 322 families. | |||||
1 | 1ZHW | - | HC2 | C27 H46 O2 | CC(C)CCC[C.... |
2 | 1ZHY | Kd = 300 nM | CLR | C27 H46 O | CC(C)CCC[C.... |
3 | 1ZHT | - | HCR | C27 H46 O2 | C[C@H](CCC.... |
4 | 4F4B | - | L39 | C27 H41 I O3 | C[C@H](CCC.... |
5 | 1ZHX | Kd = 55 nM | HC3 | C27 H46 O2 | C[C@H](CCC.... |
6 | 4FES | - | 0T9 | C28 H44 O3 | CC[C@H](C).... |
7 | 1ZHZ | - | ERG | C28 H44 O | CC(C)[C@@H.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | ERG | 1 | 1 |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | CLR | 0.9665 |
2 | HCR | 0.9612 |
3 | K2B | 0.9450 |
4 | HC3 | 0.9450 |
5 | 5JK | 0.9394 |
6 | HCD | 0.9356 |
7 | HC9 | 0.9308 |
8 | 0T9 | 0.9305 |
9 | D7S | 0.9213 |
10 | DL7 | 0.9134 |
11 | DL4 | 0.9132 |
12 | L39 | 0.9119 |
13 | HC2 | 0.9119 |
14 | 2DC | 0.9117 |
15 | TH2 | 0.8976 |
16 | 98H | 0.8916 |
17 | LAN | 0.8887 |
18 | 38O | 0.8836 |
19 | C3S | 0.8750 |
20 | 4D8 | 0.8672 |
21 | J60 | 0.8592 |
22 | HE7 | 0.8566 |
23 | 82R | 0.8554 |
This union binding pocket(no: 1) in the query (biounit: 1zhx.bio1) has 27 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |