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- Structure Biounit | Ligand Information
- PDB : .ZIP | .CSV
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- Class : .ZIP | .CSV
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 59 families. | |||||
1 | 1EVH | Kd = 602 uM | ACE PHE PRO PRO PRO PRO THR | n/a | n/a |
2 | 7A5M | Kd = 0.53 uM | ACY 2L5 2L6 R0E MOH | n/a | n/a |
3 | 6RD2 | Kd = 0.33 uM | THR GLU ASP GLU NLW K1N | n/a | n/a |
4 | 5NBX | - | PRO 2L5 ACY PRO 8SN | n/a | n/a |
5 | 5N9C | Kd = 14.1 uM | ACE 2L5 PRO PRO 92B | n/a | n/a |
6 | 6RCJ | Kd = 0.47 uM | K0H | C36 H44 Cl N5 O7 | CC[C@@H]1C.... |
7 | 7AKI | - | RJQ | C35 H41 Cl N6 O6 | CC(=O)N[C@.... |
8 | 5NCG | - | 8TB | C36 H42 Cl N5 O7 | C[C@@H]1C[.... |
9 | 5NEG | - | 8VK | C39 H48 Cl N5 O7 | CC[C@@H]1C.... |
10 | 5ND0 | - | ACE 2L5 PRO PRO 8TQ THR GLU ASP GLU NLW | n/a | n/a |
11 | 6XXR | - | ACY 2L5 PRO PRO PRO PRO 2TL | n/a | n/a |
12 | 5NCF | Kd = 10 uM | 8T5 | C36 H42 Cl N5 O7 | CC(=O)N[C@.... |
13 | 6XVT | - | ACY 2L5 PRO PRO PRO PRO NME | n/a | n/a |
14 | 5N9P | - | ACE 2L5 PRO PRO 92B NH2 | n/a | n/a |
15 | 6RCF | Kd = 0.32 uM | K0K | C35 H42 Cl N5 O7 | CC[C@@H]1C.... |
16 | 5NDU | - | 8V2 | C36 H42 Cl N5 O7 | CC(=O)N[C@.... |
17 | 5NCP | - | EG5 | C35 H40 Cl N5 O7 | CC(=O)N[C@.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 40 families. | |||||
1 | 1EVH | Kd = 602 uM | ACE PHE PRO PRO PRO PRO THR | n/a | n/a |
2 | 7A5M | Kd = 0.53 uM | ACY 2L5 2L6 R0E MOH | n/a | n/a |
3 | 6RD2 | Kd = 0.33 uM | THR GLU ASP GLU NLW K1N | n/a | n/a |
4 | 5NBX | - | PRO 2L5 ACY PRO 8SN | n/a | n/a |
5 | 5N9C | Kd = 14.1 uM | ACE 2L5 PRO PRO 92B | n/a | n/a |
6 | 6RCJ | Kd = 0.47 uM | K0H | C36 H44 Cl N5 O7 | CC[C@@H]1C.... |
7 | 7AKI | - | RJQ | C35 H41 Cl N6 O6 | CC(=O)N[C@.... |
8 | 5NCG | - | 8TB | C36 H42 Cl N5 O7 | C[C@@H]1C[.... |
9 | 5NEG | - | 8VK | C39 H48 Cl N5 O7 | CC[C@@H]1C.... |
10 | 5ND0 | - | ACE 2L5 PRO PRO 8TQ THR GLU ASP GLU NLW | n/a | n/a |
11 | 6XXR | - | ACY 2L5 PRO PRO PRO PRO 2TL | n/a | n/a |
12 | 5NCF | Kd = 10 uM | 8T5 | C36 H42 Cl N5 O7 | CC(=O)N[C@.... |
13 | 6XVT | - | ACY 2L5 PRO PRO PRO PRO NME | n/a | n/a |
14 | 5N9P | - | ACE 2L5 PRO PRO 92B NH2 | n/a | n/a |
15 | 6RCF | Kd = 0.32 uM | K0K | C35 H42 Cl N5 O7 | CC[C@@H]1C.... |
16 | 5NDU | - | 8V2 | C36 H42 Cl N5 O7 | CC(=O)N[C@.... |
17 | 5NCP | - | EG5 | C35 H40 Cl N5 O7 | CC(=O)N[C@.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | ACE 2L5 PRO PRO 8TQ THR GLU ASP GLU NLW | 1 | 1 |
2 | THR GLU ASP GLU NLW K1N | 0.777108 | 0.946667 |
3 | ACE 2L5 PRO PRO 92B | 0.633333 | 0.816901 |
4 | ACE 2L5 PRO PRO 92B NH2 | 0.622517 | 0.816901 |
5 | EG5 | 0.488372 | 0.8 |
6 | RJQ | 0.482558 | 0.773333 |
7 | 8V2 | 0.465909 | 0.753247 |
8 | ACY 2L5 PRO PRO PRO PRO 2TL | 0.464968 | 0.830986 |
9 | 8T5 | 0.455056 | 0.8 |
10 | 8TB | 0.437158 | 0.826667 |
11 | ACY 2L5 PRO PRO PRO PRO NME | 0.434211 | 0.75 |
12 | K0K | 0.418478 | 0.802632 |
13 | 8VK | 0.415789 | 0.734177 |
14 | GLN MET PRO THR GLU ASP GLU TYR | 0.403226 | 0.802632 |
15 | ACY 2L5 2L6 R0E MOH | 0.402116 | 0.782051 |
No: | Ligand | Similarity coefficient |
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This union binding pocket(no: 1) in the query (biounit: 6rcf.bio1) has 29 residues | |||
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No: | Leader PDB | Ligand | Sequence Similarity |