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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 | 1EC9 | Ki = 0.8 mM | XYH | C5 H8 N O7 | [C@H]([C@@.... |
2 | 1JDF | - | GLR | C6 H6 O7 | C([C@@H]([.... |
3 | 1EC8 | - | GLR | C6 H6 O7 | C([C@@H]([.... |
4 | 1ECQ | Ki = 1 mM | DXG | C6 H8 O7 | C([C@@H]([.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 1 families. | |||||
1 | 1EC9 | Ki = 0.8 mM | XYH | C5 H8 N O7 | [C@H]([C@@.... |
2 | 1JDF | - | GLR | C6 H6 O7 | C([C@@H]([.... |
3 | 1EC8 | - | GLR | C6 H6 O7 | C([C@@H]([.... |
4 | 1ECQ | Ki = 1 mM | DXG | C6 H8 O7 | C([C@@H]([.... |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | SOR | 0.9575 |
2 | FIX | 0.9490 |
3 | FUD | 0.9433 |
4 | DXG | 0.9395 |
5 | HQJ | 0.9389 |
6 | R20 | 0.9377 |
7 | REL | 0.9357 |
8 | GLR | 0.9327 |
9 | CS2 | 0.9318 |
10 | GCO | 0.9296 |
11 | SOL | 0.9296 |
12 | GLO | 0.9280 |
13 | MTL | 0.9278 |
14 | L5V | 0.9257 |
15 | LFC | 0.9246 |
16 | RAT | 0.9221 |
17 | AKG | 0.9208 |
18 | HA5 | 0.9184 |
19 | RLG | 0.9184 |
20 | OGA | 0.9165 |
21 | M5E | 0.9159 |
22 | ICB | 0.9157 |
23 | 61M | 0.9151 |
24 | PHE | 0.9149 |
25 | 7Q1 | 0.9148 |
26 | GLU | 0.9143 |
27 | FA3 | 0.9142 |
28 | PPY | 0.9129 |
29 | 1L5 | 0.9129 |
30 | 7QS | 0.9124 |
31 | TYR | 0.9115 |
32 | 15N | 0.9114 |
33 | KDG | 0.9106 |
34 | RNT | 0.9100 |
35 | 41K | 0.9097 |
36 | TLM | 0.9084 |
37 | S2G | 0.9075 |
38 | R2P | 0.9072 |
39 | QIC | 0.9070 |
40 | HIS | 0.9066 |
41 | C5A | 0.9065 |
42 | HL4 | 0.9047 |
43 | LTM | 0.9046 |
44 | 0QW | 0.9045 |
45 | 56D | 0.9045 |
46 | XXP | 0.9045 |
47 | CUW | 0.9044 |
48 | FA1 | 0.9039 |
49 | GLN | 0.9028 |
50 | 2UB | 0.9027 |
51 | DPN | 0.9015 |
52 | DHY | 0.9010 |
53 | RNS | 0.9006 |
54 | ASC | 0.8994 |
55 | HJH | 0.8991 |
56 | OMD | 0.8990 |
57 | 3BU | 0.8989 |
58 | ADA | 0.8987 |
59 | 3MF | 0.8986 |
60 | SMN | 0.8983 |
61 | LPK | 0.8982 |
62 | NAG | 0.8982 |
63 | NCT | 0.8975 |
64 | DAL DAL | 0.8972 |
65 | S2P | 0.8970 |
66 | HFA | 0.8970 |
67 | SHI | 0.8968 |
68 | KMH | 0.8964 |
69 | FRU | 0.8963 |
70 | ENO | 0.8962 |
71 | E4P | 0.8961 |
72 | 2HG | 0.8959 |
73 | 3C4 | 0.8959 |
74 | 40F | 0.8958 |
75 | R1P | 0.8952 |
76 | CIT | 0.8949 |
77 | LGT | 0.8940 |
78 | HNK | 0.8931 |
79 | QUS | 0.8930 |
80 | FK8 | 0.8930 |
81 | GDL | 0.8928 |
82 | M45 | 0.8927 |
83 | 3LR | 0.8921 |
84 | SD4 | 0.8921 |
85 | HCI | 0.8915 |
86 | E1P | 0.8914 |
87 | C53 | 0.8913 |
88 | A3M | 0.8911 |
89 | 3HP | 0.8905 |
90 | DGL | 0.8903 |
91 | CAX | 0.8901 |
92 | SDD | 0.8900 |
93 | F34 | 0.8898 |
94 | X1R | 0.8897 |
95 | 0OC | 0.8897 |
96 | NGT | 0.8894 |
97 | GAE | 0.8893 |
98 | NFA | 0.8893 |
99 | TAG | 0.8890 |
100 | HL5 | 0.8886 |
101 | 8VR | 0.8885 |
102 | X1P | 0.8885 |
103 | TIH | 0.8885 |
104 | XLS | 0.8884 |
105 | 9RW | 0.8880 |
106 | 2FT | 0.8879 |
107 | 15L | 0.8878 |
108 | SEP | 0.8878 |
109 | TOH | 0.8874 |
110 | B3U | 0.8873 |
111 | 8SZ | 0.8873 |
112 | ISD | 0.8872 |
113 | DGN | 0.8871 |
114 | AMQ | 0.8871 |
115 | GZ2 | 0.8869 |
116 | MES | 0.8868 |
117 | 1BN | 0.8864 |
118 | 8GL | 0.8863 |
119 | JQ5 | 0.8861 |
120 | P58 | 0.8861 |
121 | OHP | 0.8860 |
122 | HPV | 0.8858 |
123 | LY0 | 0.8857 |
124 | 1VK | 0.8855 |
125 | PO6 | 0.8851 |
126 | 9W5 | 0.8850 |
127 | FLC | 0.8849 |
128 | 7C3 | 0.8847 |
129 | DIR | 0.8846 |
130 | DHI | 0.8845 |
131 | P7Y | 0.8844 |
132 | DEW | 0.8843 |
133 | AMH | 0.8842 |
134 | L14 | 0.8842 |
135 | 3YP | 0.8842 |
136 | J0Z | 0.8842 |
137 | 3CR | 0.8840 |
138 | GVM | 0.8837 |
139 | XIZ | 0.8836 |
140 | DZA | 0.8836 |
141 | PPT | 0.8834 |
142 | Q9Z | 0.8834 |
143 | HF2 | 0.8833 |
144 | S8D | 0.8832 |
145 | TZM | 0.8832 |
146 | 11C | 0.8831 |
147 | DEE | 0.8831 |
148 | 4PN | 0.8827 |
149 | 7BC | 0.8827 |
150 | MAH | 0.8826 |
151 | SG3 | 0.8826 |
152 | 7OD | 0.8825 |
153 | DXP | 0.8824 |
154 | TAR | 0.8823 |
155 | 3AL | 0.8822 |
156 | LYS | 0.8821 |
157 | MMS | 0.8820 |
158 | 9RH | 0.8817 |
159 | TNX | 0.8816 |
160 | M74 | 0.8816 |
161 | SSC | 0.8816 |
162 | P4F | 0.8812 |
163 | NGW | 0.8812 |
164 | DER | 0.8808 |
165 | YOF | 0.8807 |
166 | TPO | 0.8806 |
167 | N2Y | 0.8806 |
168 | AL0 | 0.8804 |
169 | LSQ | 0.8804 |
170 | TYE | 0.8802 |
171 | DHM | 0.8801 |
172 | SAF | 0.8801 |
173 | OOG | 0.8800 |
174 | 2BX | 0.8799 |
175 | XUL | 0.8799 |
176 | AHC | 0.8798 |
177 | KYN | 0.8798 |
178 | 650 | 0.8797 |
179 | AHN | 0.8797 |
180 | 5WZ | 0.8797 |
181 | LX1 | 0.8796 |
182 | AOS | 0.8796 |
183 | N9J | 0.8794 |
184 | 6FZ | 0.8788 |
185 | P80 | 0.8786 |
186 | GGB | 0.8785 |
187 | R9S | 0.8785 |
188 | B40 | 0.8784 |
189 | ALA ALA | 0.8784 |
190 | 5DL | 0.8783 |
191 | URQ | 0.8782 |
192 | SQV | 0.8782 |
193 | HIC | 0.8781 |
194 | 7QD | 0.8778 |
195 | 0A9 | 0.8776 |
196 | ROR | 0.8776 |
197 | PSJ | 0.8774 |
198 | 9YT | 0.8769 |
199 | 2HC | 0.8769 |
200 | HPP | 0.8769 |
201 | 3VW | 0.8769 |
202 | 2AL | 0.8768 |
203 | 1H1 | 0.8766 |
204 | GRO | 0.8763 |
205 | GBN | 0.8762 |
206 | GC3 | 0.8761 |
207 | HGA | 0.8758 |
208 | 2D8 | 0.8757 |
209 | XQI | 0.8754 |
210 | BHU | 0.8750 |
211 | TL6 | 0.8749 |
212 | 263 | 0.8748 |
213 | 3PG | 0.8746 |
214 | M3H | 0.8743 |
215 | K6H | 0.8739 |
216 | 2IT | 0.8737 |
217 | BZQ | 0.8736 |
218 | 6JN | 0.8733 |
219 | ABF | 0.8729 |
220 | PMF | 0.8729 |
221 | 3QO | 0.8723 |
222 | 5FN | 0.8722 |
223 | PAC | 0.8719 |
224 | FOC | 0.8718 |
225 | RP5 | 0.8715 |
226 | TLA | 0.8711 |
227 | MUC | 0.8709 |
228 | 4NG | 0.8707 |
229 | UN1 | 0.8706 |
230 | PBN | 0.8696 |
231 | BRH | 0.8696 |
232 | QMP | 0.8695 |
233 | 9J3 | 0.8694 |
234 | HHI | 0.8690 |
235 | S7A | 0.8689 |
236 | RQD | 0.8689 |
237 | 5FX | 0.8688 |
238 | RBL | 0.8682 |
239 | I4B | 0.8682 |
240 | DLY | 0.8682 |
241 | DYT | 0.8677 |
242 | URO | 0.8676 |
243 | NMH | 0.8671 |
244 | HMS | 0.8669 |
245 | 0L1 | 0.8668 |
246 | HQ9 | 0.8664 |
247 | CXP | 0.8664 |
248 | DII | 0.8663 |
249 | IOP | 0.8659 |
250 | NGO | 0.8657 |
251 | HYA | 0.8656 |
252 | HG3 | 0.8649 |
253 | DA3 | 0.8647 |
254 | Q03 | 0.8647 |
255 | XRX | 0.8643 |
256 | GRQ | 0.8642 |
257 | Z70 | 0.8639 |
258 | HSX | 0.8638 |
259 | DAH | 0.8637 |
260 | LTT | 0.8637 |
261 | ZON | 0.8637 |
262 | SYC | 0.8624 |
263 | Q02 | 0.8613 |
264 | PCS | 0.8607 |
265 | B85 | 0.8605 |
266 | F9P | 0.8597 |
267 | 8U3 | 0.8596 |
268 | RUJ | 0.8595 |
269 | CLU | 0.8595 |
270 | MZT | 0.8590 |
271 | DE3 | 0.8589 |
272 | 2ED | 0.8575 |
273 | QY9 | 0.8573 |
274 | K6V | 0.8569 |
275 | NLG | 0.8564 |
276 | MP5 | 0.8562 |
277 | T2D | 0.8556 |
278 | H62 | 0.8546 |
279 | KTA | 0.8542 |
280 | M44 | 0.8526 |
281 | DS0 | 0.8522 |
282 | IYR | 0.8521 |
This union binding pocket(no: 1) in the query (biounit: 1ec9.bio1) has 19 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 1ec9.bio1) has 20 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 3) in the query (biounit: 1ec9.bio1) has 19 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 4) in the query (biounit: 1ec9.bio1) has 20 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |