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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 2 families. | |||||
1 | 3X26 | - | TAN | C5 H9 N | CC(C)(C)C#.... |
2 | 2ZPH | - | TB0 | C5 H9 N | CC(C)(C)[N.... |
3 | 3A8H | - | TAY | C5 H11 N O | CC(C)(C)C(.... |
4 | 2ZPF | - | TB0 | C5 H9 N | CC(C)(C)[N.... |
5 | 2ZPE | - | TB0 | C5 H9 N | CC(C)(C)[N.... |
6 | 2ZPI | - | TB0 | C5 H9 N | CC(C)(C)[N.... |
7 | 3A8G | - | TAN | C5 H9 N | CC(C)(C)C#.... |
8 | 3WVE | - | TAN | C5 H9 N | CC(C)(C)C#.... |
9 | 2ZPG | - | TB0 | C5 H9 N | CC(C)(C)[N.... |
10 | 3A8O | - | TAY | C5 H11 N O | CC(C)(C)C(.... |
11 | 3A8M | - | TAN | C5 H9 N | CC(C)(C)C#.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 2 families. | |||||
1 | 3X26 | - | TAN | C5 H9 N | CC(C)(C)C#.... |
2 | 2ZPH | - | TB0 | C5 H9 N | CC(C)(C)[N.... |
3 | 3A8H | - | TAY | C5 H11 N O | CC(C)(C)C(.... |
4 | 2ZPF | - | TB0 | C5 H9 N | CC(C)(C)[N.... |
5 | 2ZPE | - | TB0 | C5 H9 N | CC(C)(C)[N.... |
6 | 2ZPI | - | TB0 | C5 H9 N | CC(C)(C)[N.... |
7 | 3A8G | - | TAN | C5 H9 N | CC(C)(C)C#.... |
8 | 3WVE | - | TAN | C5 H9 N | CC(C)(C)C#.... |
9 | 2ZPG | - | TB0 | C5 H9 N | CC(C)(C)[N.... |
10 | 3A8O | - | TAY | C5 H11 N O | CC(C)(C)C(.... |
11 | 3A8M | - | TAN | C5 H9 N | CC(C)(C)C#.... |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | TB0 | 1.0000 |
2 | ETF | 0.9930 |
3 | VSO | 0.9929 |
4 | HSW | 0.9819 |
5 | 8FH | 0.9674 |
6 | 2HP | 0.9630 |
7 | MMQ | 0.9612 |
8 | 03S | 0.9608 |
9 | 2PA | 0.9562 |
10 | CHT | 0.9562 |
11 | 9XN | 0.9532 |
12 | FPO | 0.9508 |
13 | GB | 0.9492 |
14 | FUS | 0.9491 |
15 | TBU | 0.9490 |
16 | TMO | 0.9478 |
17 | PO4 | 0.9456 |
18 | PEJ | 0.9444 |
19 | ART | 0.9438 |
20 | EFS | 0.9437 |
21 | FJO | 0.9431 |
22 | BF4 | 0.9425 |
23 | GLV | 0.9413 |
24 | XPO | 0.9411 |
25 | ETM | 0.9399 |
26 | PPF | 0.9393 |
27 | 8X3 | 0.9377 |
28 | WO6 | 0.9350 |
29 | GOA | 0.9347 |
30 | TAY | 0.9330 |
31 | BU4 | 0.9310 |
32 | TAU | 0.9310 |
33 | 2A3 | 0.9308 |
34 | VX | 0.9307 |
35 | COM | 0.9300 |
36 | LAC | 0.9300 |
37 | PPI | 0.9294 |
38 | AOA | 0.9292 |
39 | GXV | 0.9291 |
40 | ALA | 0.9291 |
41 | GOL | 0.9287 |
42 | 3GR | 0.9287 |
43 | HVB | 0.9276 |
44 | BTL | 0.9269 |
45 | AKR | 0.9265 |
46 | FAH | 0.9244 |
47 | DZZ | 0.9225 |
48 | GLY | 0.9214 |
49 | POA | 0.9204 |
50 | 2HE | 0.9204 |
51 | ABA | 0.9196 |
52 | 9SB | 0.9193 |
53 | P7I | 0.9189 |
54 | HAE | 0.9182 |
55 | 61G | 0.9164 |
56 | MGX | 0.9151 |
57 | HIU | 0.9129 |
58 | HUI | 0.9124 |
59 | 03W | 0.9117 |
60 | BUB | 0.9115 |
61 | PRI | 0.9112 |
62 | F3V | 0.9108 |
63 | TSZ | 0.9107 |
64 | AGU | 0.9107 |
65 | 1AC | 0.9104 |
66 | NIE | 0.9104 |
67 | MR3 | 0.9100 |
68 | BAL | 0.9089 |
69 | NMU | 0.9082 |
70 | DGY | 0.9080 |
71 | SMB | 0.9079 |
72 | F50 | 0.9077 |
73 | 2MZ | 0.9075 |
74 | NHY | 0.9068 |
75 | 5MP | 0.9066 |
76 | 1BP | 0.9059 |
77 | 1MZ | 0.9058 |
78 | 3TR | 0.9055 |
79 | 2AI | 0.9054 |
80 | 2A1 | 0.9049 |
81 | 4MZ | 0.9046 |
82 | PYR | 0.9043 |
83 | HOW | 0.9041 |
84 | J3K | 0.9040 |
85 | THR | 0.9031 |
86 | CYS | 0.9013 |
87 | 2HA | 0.9008 |
88 | 1CB | 0.9003 |
89 | 39J | 0.9002 |
90 | CP2 | 0.8994 |
91 | D2P | 0.8994 |
92 | SER | 0.8994 |
93 | 6SP | 0.8984 |
94 | MEU | 0.8983 |
95 | 4AX | 0.8983 |
96 | NCM | 0.8980 |
97 | JZ6 | 0.8979 |
98 | DSN | 0.8979 |
99 | BMD | 0.8977 |
100 | R3W | 0.8975 |
101 | 2RA | 0.8974 |
102 | 5KX | 0.8973 |
103 | SAR | 0.8967 |
104 | GBL | 0.8966 |
105 | A3B | 0.8961 |
106 | DBB | 0.8961 |
107 | HLT | 0.8958 |
108 | BAQ | 0.8949 |
109 | DAL | 0.8939 |
110 | ATO | 0.8938 |
111 | TZZ | 0.8932 |
112 | ES3 | 0.8931 |
113 | NIS | 0.8929 |
114 | 3BB | 0.8927 |
115 | 1SP | 0.8925 |
116 | BUA | 0.8924 |
117 | DE2 | 0.8915 |
118 | BXA | 0.8913 |
119 | PXO | 0.8913 |
120 | AMT | 0.8904 |
121 | OXL | 0.8897 |
122 | BUQ | 0.8896 |
123 | BYZ | 0.8884 |
124 | MLI | 0.8882 |
125 | BAE | 0.8882 |
126 | HGY | 0.8875 |
127 | MZY | 0.8874 |
128 | CP | 0.8870 |
129 | ALQ | 0.8865 |
130 | 9A4 | 0.8858 |
131 | 3MT | 0.8857 |
132 | 2OP | 0.8855 |
133 | DXX | 0.8852 |
134 | HBS | 0.8851 |
135 | MZ0 | 0.8850 |
136 | OXM | 0.8846 |
137 | PYM | 0.8844 |
138 | BRP | 0.8837 |
139 | C2N | 0.8833 |
140 | HBR | 0.8830 |
141 | ICN | 0.8828 |
142 | 3OH | 0.8827 |
143 | 3HR | 0.8826 |
144 | HV2 | 0.8826 |
145 | DCY | 0.8821 |
146 | FMS | 0.8816 |
147 | EGD | 0.8813 |
148 | MLA | 0.8806 |
149 | TFS | 0.8800 |
150 | PYZ | 0.8796 |
151 | 3ZS | 0.8784 |
152 | NAK | 0.8773 |
153 | SSN | 0.8773 |
154 | TF4 | 0.8766 |
155 | DMG | 0.8764 |
156 | OXD | 0.8756 |
157 | BUO | 0.8755 |
158 | 192 | 0.8748 |
159 | ATQ | 0.8733 |
160 | PUT | 0.8726 |
161 | FCN | 0.8703 |
162 | MPD | 0.8690 |
163 | ASP | 0.8679 |
164 | PRO | 0.8670 |
165 | XAP | 0.8646 |
166 | TCV | 0.8638 |
167 | AKB | 0.8629 |
168 | BVG | 0.8626 |
169 | NVI | 0.8625 |
170 | PAE | 0.8621 |
171 | 40O | 0.8615 |
172 | DTL | 0.8608 |
173 | 3CL | 0.8607 |
174 | 2EZ | 0.8592 |
175 | S0H | 0.8588 |
176 | VAL | 0.8584 |
177 | C5J | 0.8566 |
178 | TB6 | 0.8550 |
179 | TFB | 0.8535 |
180 | ACT | 0.8518 |
This union binding pocket(no: 1) in the query (biounit: 3a8h.bio1) has 11 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |