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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 1331 families. | |||||
1 | 3H3R | - | 14H | C24 H41 N O3 | CCCCCCCCCC.... |
2 | 2E3R | - | 18C | C36 H71 N O3 | CCCCCCCCCC.... |
3 | 3H3S | - | H15 | C25 H43 N O3 | CCCCCCCCCC.... |
4 | 2E3P | - | 16C | C34 H67 N O3 | CCCCCCCCCC.... |
5 | 2Z9Y | - | DDR | C23 H44 O5 | CCCCCCCCCC.... |
6 | 3H3Q | - | H13 | C23 H39 N O3 | CCCCCCCCCC.... |
7 | 2Z9Z | - | DDR | C23 H44 O5 | CCCCCCCCCC.... |
8 | 2E3N | - | 6CM | C24 H47 N O3 | CCCCCCCCCC.... |
9 | 2E3O | - | 16C | C34 H67 N O3 | CCCCCCCCCC.... |
10 | 3H3T | - | 16H | C26 H45 N O3 | CCCCCCCCCC.... |
11 | 2E3Q | - | 18C | C36 H71 N O3 | CCCCCCCCCC.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 1144 families. | |||||
1 | 3H3R | - | 14H | C24 H41 N O3 | CCCCCCCCCC.... |
2 | 2E3R | - | 18C | C36 H71 N O3 | CCCCCCCCCC.... |
3 | 3H3S | - | H15 | C25 H43 N O3 | CCCCCCCCCC.... |
4 | 2E3P | - | 16C | C34 H67 N O3 | CCCCCCCCCC.... |
5 | 2Z9Y | - | DDR | C23 H44 O5 | CCCCCCCCCC.... |
6 | 3H3Q | - | H13 | C23 H39 N O3 | CCCCCCCCCC.... |
7 | 2Z9Z | - | DDR | C23 H44 O5 | CCCCCCCCCC.... |
8 | 2E3N | - | 6CM | C24 H47 N O3 | CCCCCCCCCC.... |
9 | 2E3O | - | 16C | C34 H67 N O3 | CCCCCCCCCC.... |
10 | 3H3T | - | 16H | C26 H45 N O3 | CCCCCCCCCC.... |
11 | 2E3Q | - | 18C | C36 H71 N O3 | CCCCCCCCCC.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | 18C | 1 | 1 |
2 | SPL | 1 | 1 |
3 | 16C | 1 | 1 |
4 | 6CM | 0.94 | 1 |
5 | 2ED | 0.735849 | 0.97561 |
6 | 1PX | 0.666667 | 0.722222 |
7 | 1PZ | 0.666667 | 0.722222 |
8 | 1PW | 0.522388 | 0.703704 |
9 | 3XU | 0.5125 | 0.619048 |
10 | FO4 | 0.5125 | 0.619048 |
11 | 03F | 0.512195 | 0.759259 |
12 | SPH | 0.491228 | 0.785714 |
13 | SQS | 0.491228 | 0.785714 |
14 | BGC 18C GAL | 0.461538 | 0.732143 |
15 | 1K4 | 0.435484 | 0.8 |
16 | IGC | 0.424242 | 0.732143 |
17 | LGN | 0.424242 | 0.732143 |
18 | S1P | 0.41791 | 0.611111 |
19 | OLB | 0.41791 | 0.608696 |
20 | OLC | 0.41791 | 0.608696 |
21 | A9M | 0.403509 | 0.790698 |
22 | 16H | 0.402778 | 0.844444 |
23 | H15 | 0.402778 | 0.844444 |
24 | H13 | 0.402778 | 0.844444 |
25 | 14H | 0.402778 | 0.844444 |
No: | Ligand | Similarity coefficient |
---|
This union binding pocket(no: 1) in the query (biounit: 2e3n.bio1) has 33 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |