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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 261 families. | |||||
1 | 1YNS | - | HPO | C7 H15 O4 P | CCCCCC(=O).... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 214 families. | |||||
1 | 1YNS | - | HPO | C7 H15 O4 P | CCCCCC(=O).... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | HPO | 1 | 1 |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | PUW | 0.9320 |
2 | AZM | 0.9226 |
3 | N8C | 0.9138 |
4 | BGT | 0.9115 |
5 | 011 | 0.9111 |
6 | P23 | 0.9088 |
7 | DMA | 0.9088 |
8 | IPE | 0.9081 |
9 | M3L | 0.9081 |
10 | 0CN | 0.9052 |
11 | STX | 0.9042 |
12 | 0CG | 0.9040 |
13 | 0CM | 0.9039 |
14 | OCA | 0.9038 |
15 | VFG | 0.9023 |
16 | 58X | 0.8992 |
17 | 3W8 | 0.8982 |
18 | ARG | 0.8981 |
19 | GVA | 0.8975 |
20 | KNA | 0.8974 |
21 | RGP | 0.8970 |
22 | DHM | 0.8959 |
23 | AG2 | 0.8951 |
24 | KPC | 0.8951 |
25 | LUQ | 0.8914 |
26 | 1HS | 0.8914 |
27 | IPR | 0.8909 |
28 | MLZ | 0.8899 |
29 | TEG | 0.8893 |
30 | EXY | 0.8889 |
31 | NWH | 0.8889 |
32 | PML | 0.8885 |
33 | BOW | 0.8883 |
34 | HPN | 0.8882 |
35 | D10 | 0.8881 |
36 | 3W3 | 0.8881 |
37 | ACA | 0.8878 |
38 | SHV | 0.8873 |
39 | 1AE | 0.8871 |
40 | E8U | 0.8865 |
41 | DKA | 0.8859 |
42 | B3M | 0.8855 |
43 | 3GZ | 0.8844 |
44 | 4DI | 0.8840 |
45 | ENV | 0.8840 |
46 | GGG | 0.8838 |
47 | 3W6 | 0.8838 |
48 | 1N5 | 0.8836 |
49 | 7XA | 0.8834 |
50 | CUW | 0.8832 |
51 | NMH | 0.8827 |
52 | SPD | 0.8822 |
53 | KQY | 0.8821 |
54 | GGB | 0.8807 |
55 | 8AC | 0.8803 |
56 | OHJ | 0.8800 |
57 | LYS | 0.8799 |
58 | IAR | 0.8797 |
59 | 2J3 | 0.8795 |
60 | MHN | 0.8792 |
61 | 5SP | 0.8789 |
62 | CLT | 0.8785 |
63 | DXP | 0.8785 |
64 | DED | 0.8783 |
65 | 64Z | 0.8780 |
66 | ENW | 0.8776 |
67 | DZA | 0.8774 |
68 | N6C | 0.8773 |
69 | DIA | 0.8770 |
70 | XOG | 0.8770 |
71 | AE3 | 0.8766 |
72 | 7MW | 0.8761 |
73 | PBN | 0.8760 |
74 | JX7 | 0.8750 |
75 | 3H2 | 0.8747 |
76 | M1T | 0.8744 |
77 | 0L1 | 0.8744 |
78 | GLY GLY GLY | 0.8744 |
79 | 6C4 | 0.8742 |
80 | ODI | 0.8742 |
81 | GRQ | 0.8741 |
82 | U4G | 0.8740 |
83 | ISY | 0.8731 |
84 | VFM | 0.8729 |
85 | MLY | 0.8728 |
86 | HRG | 0.8720 |
87 | 8SZ | 0.8720 |
88 | ONH | 0.8720 |
89 | A5P | 0.8715 |
90 | OC9 | 0.8710 |
91 | 5RP | 0.8709 |
92 | NPI | 0.8708 |
93 | HPL | 0.8707 |
94 | FXY | 0.8706 |
95 | EGV | 0.8705 |
96 | LPA | 0.8704 |
97 | NOT | 0.8699 |
98 | ZZU | 0.8689 |
99 | RES | 0.8688 |
100 | 5LD | 0.8687 |
101 | MZM | 0.8687 |
102 | SSB | 0.8686 |
103 | PMV | 0.8686 |
104 | EIP | 0.8685 |
105 | 6XA | 0.8684 |
106 | DX5 | 0.8682 |
107 | 5TO | 0.8680 |
108 | 9J6 | 0.8679 |
109 | DLY | 0.8678 |
110 | R52 | 0.8678 |
111 | HAR | 0.8673 |
112 | ALY | 0.8670 |
113 | NNH | 0.8665 |
114 | 4TP | 0.8654 |
115 | ASF | 0.8650 |
116 | CIR | 0.8639 |
117 | 7UC | 0.8638 |
118 | MVH | 0.8635 |
119 | R5P | 0.8632 |
120 | DNN | 0.8631 |
121 | OYA | 0.8631 |
122 | NBB | 0.8626 |
123 | DAR | 0.8626 |
124 | AHL | 0.8624 |
125 | HNE | 0.8619 |
126 | DA3 | 0.8605 |
127 | LXP | 0.8602 |
128 | EZ1 | 0.8592 |
129 | MGB | 0.8564 |
130 | ILO | 0.8555 |
131 | HJD | 0.8554 |
This union binding pocket(no: 1) in the query (biounit: 1yns.bio1) has 12 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |