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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 21 families. | |||||
1 | 1O7A | - | GDL | C8 H13 N O6 | CC(=O)N[C@.... |
2 | 1NOW | - | IFG | C8 H16 N2 O4 | CC(=O)N[C@.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 16 families. | |||||
1 | 1O7A | - | GDL | C8 H13 N O6 | CC(=O)N[C@.... |
2 | 1NOW | - | IFG | C8 H16 N2 O4 | CC(=O)N[C@.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | IFG | 1 | 1 |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | A2G | 0.9807 |
2 | GNL | 0.9790 |
3 | NGA | 0.9751 |
4 | NSG | 0.9703 |
5 | 3XR | 0.9613 |
6 | NAG | 0.9567 |
7 | DJN | 0.9562 |
8 | BBK | 0.9484 |
9 | TNX | 0.9448 |
10 | NGT | 0.9430 |
11 | NDG | 0.9401 |
12 | GDL | 0.9397 |
13 | NOK | 0.9383 |
14 | ZPF | 0.9380 |
15 | NGW | 0.9274 |
16 | EPR | 0.9253 |
17 | HHT | 0.9239 |
18 | GZQ | 0.9206 |
19 | K82 | 0.9205 |
20 | 57O | 0.9154 |
21 | BEU | 0.9149 |
22 | SIZ | 0.9133 |
23 | NGO | 0.9125 |
24 | 86L | 0.9122 |
25 | F34 | 0.9108 |
26 | GC3 | 0.9102 |
27 | 2GS | 0.9099 |
28 | 54Z | 0.9063 |
29 | GC2 | 0.9026 |
30 | NFM | 0.9026 |
31 | PQZ | 0.9019 |
32 | 9R5 | 0.9017 |
33 | LTM | 0.8997 |
34 | BM3 | 0.8988 |
35 | IAC | 0.8976 |
36 | BNX | 0.8962 |
37 | NLA | 0.8960 |
38 | MS9 | 0.8949 |
39 | W81 | 0.8937 |
40 | CFA | 0.8930 |
41 | 6FZ | 0.8926 |
42 | KP6 | 0.8926 |
43 | TSR | 0.8909 |
44 | 5FN | 0.8899 |
45 | 2CZ | 0.8896 |
46 | S24 | 0.8890 |
47 | AMG | 0.8890 |
48 | 3DM | 0.8889 |
49 | MQB | 0.8878 |
50 | 1BW | 0.8877 |
51 | MNP | 0.8872 |
52 | OMD | 0.8869 |
53 | HQ9 | 0.8869 |
54 | MS0 | 0.8862 |
55 | NVU | 0.8861 |
56 | ICB | 0.8858 |
57 | QUS | 0.8857 |
58 | IOS | 0.8849 |
59 | FLC | 0.8843 |
60 | 7QS | 0.8840 |
61 | PA5 | 0.8838 |
62 | A6P | 0.8836 |
63 | 2AL | 0.8835 |
64 | MP5 | 0.8833 |
65 | XEN | 0.8833 |
66 | MAG | 0.8826 |
67 | GLC | 0.8824 |
68 | NLG | 0.8823 |
69 | SR1 | 0.8814 |
70 | SBK | 0.8814 |
71 | NOJ | 0.8811 |
72 | HJ7 | 0.8810 |
73 | 0JD | 0.8807 |
74 | ZB1 | 0.8802 |
75 | AEH | 0.8791 |
76 | YI6 | 0.8790 |
77 | LOG | 0.8789 |
78 | YTX | 0.8785 |
79 | PSJ | 0.8777 |
80 | 7Q1 | 0.8777 |
81 | 3BU | 0.8764 |
82 | TAG | 0.8761 |
83 | SF6 | 0.8760 |
84 | SRO | 0.8760 |
85 | LLH | 0.8759 |
86 | TSS | 0.8758 |
87 | SOR | 0.8758 |
88 | IOP | 0.8757 |
89 | GLO | 0.8754 |
90 | CSN | 0.8754 |
91 | LPK | 0.8753 |
92 | CIT | 0.8750 |
93 | CS2 | 0.8747 |
94 | HWD | 0.8740 |
95 | ICT | 0.8738 |
96 | DVQ | 0.8738 |
97 | HSX | 0.8735 |
98 | 0LH | 0.8734 |
99 | FTV | 0.8733 |
100 | 9KH | 0.8720 |
101 | KG1 | 0.8718 |
102 | BCU | 0.8707 |
103 | 14W | 0.8705 |
104 | 61M | 0.8702 |
105 | PMP | 0.8698 |
106 | HQ6 | 0.8695 |
107 | EV3 | 0.8695 |
108 | AOS | 0.8694 |
109 | X1P | 0.8690 |
110 | RES | 0.8689 |
111 | I2E | 0.8681 |
112 | 9BF | 0.8681 |
113 | FWD | 0.8676 |
114 | PLP | 0.8666 |
115 | PPT | 0.8656 |
116 | GCO | 0.8653 |
117 | 5WZ | 0.8648 |
118 | LFC | 0.8647 |
119 | GL1 | 0.8645 |
120 | ASC | 0.8639 |
121 | SQV | 0.8639 |
122 | MFU | 0.8638 |
123 | BDF | 0.8636 |
124 | 4HM | 0.8633 |
125 | A5P | 0.8631 |
126 | IFL | 0.8626 |
127 | 790 | 0.8622 |
128 | LYL | 0.8622 |
129 | NPA | 0.8615 |
130 | FUD | 0.8608 |
131 | SFU | 0.8606 |
132 | ZON | 0.8606 |
133 | EUG | 0.8602 |
134 | MZM | 0.8598 |
135 | ARW | 0.8592 |
136 | FA3 | 0.8590 |
137 | CIP | 0.8585 |
138 | CWD | 0.8584 |
139 | 1AL | 0.8579 |
140 | HJH | 0.8579 |
141 | SDD | 0.8576 |
142 | IWD | 0.8575 |
143 | BWD | 0.8574 |
144 | FA1 | 0.8572 |
145 | DXP | 0.8566 |
146 | FRU | 0.8564 |
147 | BK9 | 0.8555 |
148 | OIA | 0.8529 |
149 | STT | 0.8528 |
150 | 3S6 | 0.8524 |
151 | HA5 | 0.8518 |
152 | AOR | 0.8506 |
This union binding pocket(no: 1) in the query (biounit: 1now.bio2) has 27 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 1now.bio2) has 27 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 3) in the query (biounit: 1now.bio1) has 27 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 4) in the query (biounit: 1now.bio1) has 27 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |