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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 1 families. | |||||
1 | 1ZLQ | - | EDT | C10 H16 N2 O8 | C(CN(CC(=O.... |
2 | 3DP8 | - | HCT | C7 H10 O6 | C(CC(=O)O).... |
3 | 7A0C | - | QTT | C23 H32 N4 O2 | Cc1cccc(n1.... |
4 | 4I8C | - | HIS | C6 H10 N3 O2 | c1c([nH+]c.... |
5 | 4OES | - | EDT | C10 H16 N2 O8 | C(CN(CC(=O.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 165 families. | |||||
1 | 1ZLQ | - | EDT | C10 H16 N2 O8 | C(CN(CC(=O.... |
2 | 3DP8 | - | HCT | C7 H10 O6 | C(CC(=O)O).... |
3 | 7A0C | - | QTT | C23 H32 N4 O2 | Cc1cccc(n1.... |
4 | 4I8C | - | HIS | C6 H10 N3 O2 | c1c([nH+]c.... |
5 | 5YHG | Kd = 952.3 nM | 8UX | C13 H20 N4 O6 | C[C@@H](C(.... |
6 | 5YHE | Kd = 203.3 nM | 8UX | C13 H20 N4 O6 | C[C@@H](C(.... |
7 | 5YH8 | Kd = 167.8 nM | 8UX | C13 H20 N4 O6 | C[C@@H](C(.... |
8 | 4OES | - | EDT | C10 H16 N2 O8 | C(CN(CC(=O.... |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | NLG | 0.9819 |
2 | NLQ | 0.9542 |
3 | ICT | 0.9450 |
4 | HCA | 0.9409 |
5 | 7QD | 0.9343 |
6 | AOR | 0.9306 |
7 | CIT | 0.9298 |
8 | NQM | 0.9262 |
9 | NIG | 0.9215 |
10 | G88 | 0.9178 |
11 | FLC | 0.9176 |
12 | NCD | 0.9155 |
13 | EKN | 0.9135 |
14 | G01 | 0.9108 |
15 | RSM | 0.9045 |
16 | BRR | 0.9021 |
17 | MZM | 0.9010 |
18 | AQK | 0.8996 |
19 | AVO | 0.8995 |
20 | CDT | 0.8992 |
21 | NAG | 0.8989 |
22 | GLY LEU | 0.8970 |
23 | ALA LEU | 0.8961 |
24 | AME | 0.8952 |
25 | HJ7 | 0.8929 |
26 | GLY ASP | 0.8906 |
27 | 23N | 0.8903 |
28 | NFQ | 0.8895 |
29 | ALA DGL | 0.8862 |
30 | XQB | 0.8861 |
31 | DG2 | 0.8847 |
32 | TNG | 0.8832 |
33 | DZA | 0.8829 |
34 | PCV | 0.8818 |
35 | P4B | 0.8794 |
36 | 5DL | 0.8791 |
37 | 5UK | 0.8788 |
38 | ALA GLN | 0.8766 |
39 | 0FA | 0.8761 |
40 | 7UC | 0.8752 |
41 | 5TO | 0.8743 |
42 | IPE | 0.8743 |
43 | ALA ZGL | 0.8736 |
44 | PJL | 0.8720 |
45 | A5P | 0.8717 |
46 | DY8 | 0.8709 |
47 | AOZ | 0.8698 |
48 | 0CG | 0.8692 |
49 | NTC | 0.8685 |
50 | P23 | 0.8662 |
51 | M72 | 0.8658 |
52 | AQQ | 0.8650 |
53 | 2ED | 0.8647 |
54 | 3XR | 0.8643 |
55 | S7G | 0.8642 |
56 | AN0 | 0.8640 |
57 | VPR | 0.8633 |
58 | 3MF | 0.8623 |
59 | 64Z | 0.8618 |
60 | 7A3 | 0.8616 |
61 | 2OR | 0.8613 |
62 | 5RP | 0.8608 |
63 | M75 | 0.8601 |
64 | RES | 0.8599 |
65 | 8WQ | 0.8578 |
66 | NBB | 0.8575 |
67 | NGA | 0.8564 |
68 | SDD | 0.8537 |
69 | DED | 0.8526 |
This union binding pocket(no: 1) in the query (biounit: 1zlq.bio1) has 15 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 1zlq.bio2) has 16 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |