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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 15 families. | |||||
1 | 3OLE | Ki = 0.0147 uM | GLC GLC G6D GLC ACI G6D ACI | n/a | n/a |
2 | 5EMY | - | 5QP | C13 H24 O10 | C1[C@H]([C.... |
3 | 1XD0 | Ki = 0.075 uM | ARE | C31 H53 N O23 | C[C@@H]1[C.... |
4 | 1U2Y | Ki = 18 mM | GOX | C6 H12 N2 O5 | C([C@@H]1[.... |
5 | 3OLD | Ki = 1.2549 uM | GLC GLC G6D GLC ACI GLC | n/a | n/a |
6 | 1XH0 | - | AAO | C37 H63 N O28 | C[C@@H]1[C.... |
7 | 1XD1 | Ki = 0.012 uM | 6SA | C37 H63 N O28 | C[C@@H]1[C.... |
8 | 3CPU | - | GLC GLC | n/a | n/a |
9 | 1U33 | Ki = 25 uM | LM2 | C19 H34 N2 O15 | CO[C@@H]1[.... |
10 | 1XH2 | - | ARE | C31 H53 N O23 | C[C@@H]1[C.... |
11 | 3OLG | Ki = 0.0143 uM | BGC GLC G6D GLC HSD G6D HSD | n/a | n/a |
12 | 3BAY | - | ARE | C31 H53 N O23 | C[C@@H]1[C.... |
13 | 1Z32 | - | AGL GLC HMC | n/a | n/a |
14 | 3DHP | - | GLC GLC AGL HMC | n/a | n/a |
15 | 3IJ7 | - | GLF B8D | n/a | n/a |
16 | 5TD4 | - | GLC GLC GLC GLC GLC GLC | n/a | n/a |
17 | 3OLI | Ki = 0.0416 uM | GLC GLC G6D GLC HSD G6D HSD | n/a | n/a |
18 | 1U30 | Ki = 1.8 mM | GOX | C6 H12 N2 O5 | C([C@@H]1[.... |
19 | 1XCX | - | BGC GLC AC1 | n/a | n/a |
20 | 4W93 | Ki = 8 nM | 3L9 | C53 H64 O33 | C[C@H]1[C@.... |
21 | 1CPU | - | GLC GLC AGL HMC GLC | n/a | n/a |
22 | 1XCW | - | GLC AC1 | n/a | n/a |
23 | 2QV4 | - | QV4 | C31 H53 N O23 | C[C@@H]1[C.... |
24 | 3IJ9 | - | B0D | C6 H10 F2 O5 | C([C@]1([C.... |
25 | 6OCN | - | NAG | C8 H15 N O6 | CC(=O)N[C@.... |
26 | 3IJ8 | - | B0D | C6 H10 F2 O5 | C([C@]1([C.... |
27 | 6OBX | - | ZXU | C36 H32 N2 O12 | c1cc(ccc1C.... |
28 | 1NM9 | - | GLC AGL HMC | n/a | n/a |
29 | 4GQQ | - | 0XR | C11 H12 O4 | CCOC(=O)/C.... |
30 | 3BAJ | - | ARE | C31 H53 N O23 | C[C@@H]1[C.... |
31 | 4GQR | Ki = 110 uM | MYC | C15 H10 O8 | c1c(cc(c(c.... |
32 | 1OSE | - | BGC AC1 GLC AC1 | n/a | n/a |
33 | 3L2M | - | GLC GLC GLC GLC GLC GLC | n/a | n/a |
34 | 1HX0 | - | GLC AC1 GLC AC1 | n/a | n/a |
35 | 1WO2 | - | BGC GLC GLC | n/a | n/a |
36 | 1JFH | Ki = 9 mM | MA3 MA2 | n/a | n/a |
37 | 3L2L | - | GLC GLC GLC GLC | n/a | n/a |
38 | 1UA3 | - | GLC GLC GLC | n/a | n/a |
39 | 1VAH | - | NPO | C6 H5 N O3 | c1cc(ccc1[.... |
40 | 1PPI | Ki = 9.7 uM | BGC GLC DAF GLC | n/a | n/a |
41 | 1PIG | ic50 = 0.7 nM | BGC GLC AGL GLC HMC AGL | n/a | n/a |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 12 families. | |||||
1 | 3OLE | Ki = 0.0147 uM | GLC GLC G6D GLC ACI G6D ACI | n/a | n/a |
2 | 5EMY | - | 5QP | C13 H24 O10 | C1[C@H]([C.... |
3 | 1XD0 | Ki = 0.075 uM | ARE | C31 H53 N O23 | C[C@@H]1[C.... |
4 | 1U2Y | Ki = 18 mM | GOX | C6 H12 N2 O5 | C([C@@H]1[.... |
5 | 3OLD | Ki = 1.2549 uM | GLC GLC G6D GLC ACI GLC | n/a | n/a |
6 | 1XH0 | - | AAO | C37 H63 N O28 | C[C@@H]1[C.... |
7 | 1XD1 | Ki = 0.012 uM | 6SA | C37 H63 N O28 | C[C@@H]1[C.... |
8 | 3CPU | - | GLC GLC | n/a | n/a |
9 | 1U33 | Ki = 25 uM | LM2 | C19 H34 N2 O15 | CO[C@@H]1[.... |
10 | 1XH2 | - | ARE | C31 H53 N O23 | C[C@@H]1[C.... |
11 | 3OLG | Ki = 0.0143 uM | BGC GLC G6D GLC HSD G6D HSD | n/a | n/a |
12 | 3BAY | - | ARE | C31 H53 N O23 | C[C@@H]1[C.... |
13 | 1Z32 | - | AGL GLC HMC | n/a | n/a |
14 | 3DHP | - | GLC GLC AGL HMC | n/a | n/a |
15 | 3IJ7 | - | GLF B8D | n/a | n/a |
16 | 5TD4 | - | GLC GLC GLC GLC GLC GLC | n/a | n/a |
17 | 3OLI | Ki = 0.0416 uM | GLC GLC G6D GLC HSD G6D HSD | n/a | n/a |
18 | 1U30 | Ki = 1.8 mM | GOX | C6 H12 N2 O5 | C([C@@H]1[.... |
19 | 1XCX | - | BGC GLC AC1 | n/a | n/a |
20 | 4W93 | Ki = 8 nM | 3L9 | C53 H64 O33 | C[C@H]1[C@.... |
21 | 1CPU | - | GLC GLC AGL HMC GLC | n/a | n/a |
22 | 1XCW | - | GLC AC1 | n/a | n/a |
23 | 2QV4 | - | QV4 | C31 H53 N O23 | C[C@@H]1[C.... |
24 | 3IJ9 | - | B0D | C6 H10 F2 O5 | C([C@]1([C.... |
25 | 6OCN | - | NAG | C8 H15 N O6 | CC(=O)N[C@.... |
26 | 3IJ8 | - | B0D | C6 H10 F2 O5 | C([C@]1([C.... |
27 | 6OBX | - | ZXU | C36 H32 N2 O12 | c1cc(ccc1C.... |
28 | 1NM9 | - | GLC AGL HMC | n/a | n/a |
29 | 4GQQ | - | 0XR | C11 H12 O4 | CCOC(=O)/C.... |
30 | 3BAJ | - | ARE | C31 H53 N O23 | C[C@@H]1[C.... |
31 | 4GQR | Ki = 110 uM | MYC | C15 H10 O8 | c1c(cc(c(c.... |
32 | 6M4M | - | GLC GLC GLC GLC GLC GLC | n/a | n/a |
33 | 1OSE | - | BGC AC1 GLC AC1 | n/a | n/a |
34 | 3L2M | - | GLC GLC GLC GLC GLC GLC | n/a | n/a |
35 | 1HX0 | - | GLC AC1 GLC AC1 | n/a | n/a |
36 | 1WO2 | - | BGC GLC GLC | n/a | n/a |
37 | 1JFH | Ki = 9 mM | MA3 MA2 | n/a | n/a |
38 | 3L2L | - | GLC GLC GLC GLC | n/a | n/a |
39 | 1UA3 | - | GLC GLC GLC | n/a | n/a |
40 | 1VAH | - | NPO | C6 H5 N O3 | c1cc(ccc1[.... |
41 | 1PPI | Ki = 9.7 uM | BGC GLC DAF GLC | n/a | n/a |
42 | 1PIG | ic50 = 0.7 nM | BGC GLC AGL GLC HMC AGL | n/a | n/a |
43 | 1G94 | - | GLC GLC GLC DAF DAF | n/a | n/a |
44 | 1KXH | - | GLC GLC AC1 | n/a | n/a |
45 | 1G9H | - | BGC DAF | n/a | n/a |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | 5DI | 0.9601 |
2 | CGB | 0.9579 |
3 | SOE | 0.9382 |
4 | GLC | 0.9365 |
5 | FRU | 0.9313 |
6 | BGC | 0.9293 |
7 | AFR | 0.9276 |
8 | FUC | 0.9275 |
9 | GIV | 0.9257 |
10 | BDF | 0.9252 |
11 | FUL | 0.9250 |
12 | GAL | 0.9236 |
13 | MAN | 0.9221 |
14 | NOJ | 0.9221 |
15 | RM4 | 0.9215 |
16 | MFU | 0.9212 |
17 | HXX | 0.9209 |
18 | 948 | 0.9190 |
19 | ARW | 0.9187 |
20 | PSV | 0.9183 |
21 | GLA | 0.9183 |
22 | GCS | 0.9170 |
23 | BMA | 0.9170 |
24 | 8S0 | 0.9165 |
25 | 64K | 0.9165 |
26 | 4PW | 0.9159 |
27 | INS | 0.9157 |
28 | G3F | 0.9151 |
29 | DZX | 0.9149 |
30 | FCB | 0.9147 |
31 | LFR | 0.9143 |
32 | LGC | 0.9137 |
33 | 3RK | 0.9136 |
34 | H62 | 0.9132 |
35 | LCN | 0.9129 |
36 | ISE | 0.9127 |
37 | LKA | 0.9122 |
38 | 2FG | 0.9119 |
39 | ARB | 0.9116 |
40 | 3HA | 0.9109 |
41 | PA1 | 0.9105 |
42 | XXR | 0.9102 |
43 | CTS | 0.9099 |
44 | MMA | 0.9094 |
45 | 149 | 0.9092 |
46 | 95Z | 0.9092 |
47 | G5V | 0.9091 |
48 | G2F | 0.9091 |
49 | 6HQ | 0.9089 |
50 | QIC | 0.9081 |
51 | 6F0 | 0.9074 |
52 | RNS | 0.9074 |
53 | SEJ | 0.9073 |
54 | XYP | 0.9072 |
55 | GLF | 0.9071 |
56 | 7D2 | 0.9068 |
57 | RAM | 0.9067 |
58 | CIP | 0.9065 |
59 | FBT | 0.9063 |
60 | D3M | 0.9057 |
61 | GLO | 0.9055 |
62 | GRE | 0.9054 |
63 | 6M1 | 0.9051 |
64 | IFM | 0.9049 |
65 | KBG | 0.9047 |
66 | MBG | 0.9044 |
67 | XYS | 0.9044 |
68 | FA3 | 0.9042 |
69 | 6LW | 0.9034 |
70 | IFL | 0.9030 |
71 | 3F0 | 0.9029 |
72 | RIP | 0.9028 |
73 | ASO | 0.9023 |
74 | LRH | 0.9023 |
75 | PFB | 0.9022 |
76 | 3MG | 0.9019 |
77 | AMG | 0.9017 |
78 | GXL | 0.9017 |
79 | I1N | 0.9015 |
80 | X6X | 0.9013 |
81 | SF9 | 0.9008 |
82 | ADA | 0.9007 |
83 | 3U4 | 0.9005 |
84 | LXC | 0.8995 |
85 | 3FH | 0.8992 |
86 | ZXD | 0.8989 |
87 | 3SK | 0.8989 |
88 | 3WA | 0.8988 |
89 | FA1 | 0.8986 |
90 | X09 | 0.8983 |
91 | MNM | 0.8980 |
92 | GAF | 0.8975 |
93 | 0MK | 0.8975 |
94 | DMJ | 0.8974 |
95 | 329 | 0.8972 |
96 | SFU | 0.8971 |
97 | ARA | 0.8970 |
98 | GCU | 0.8970 |
99 | IF7 | 0.8965 |
100 | 6KX | 0.8963 |
101 | LSA | 0.8963 |
102 | AUD | 0.8961 |
103 | 94B | 0.8960 |
104 | 3M0 | 0.8960 |
105 | WOO | 0.8954 |
106 | FUF | 0.8949 |
107 | DIG | 0.8948 |
108 | X05 | 0.8943 |
109 | BDP | 0.8938 |
110 | SF6 | 0.8931 |
111 | OXZ | 0.8929 |
112 | G4D | 0.8929 |
113 | ASC | 0.8925 |
114 | FCA | 0.8924 |
115 | PXL | 0.8923 |
116 | GYP | 0.8923 |
117 | NOY | 0.8921 |
118 | AZF | 0.8921 |
119 | SWA | 0.8920 |
120 | TLA | 0.8918 |
121 | TEP | 0.8917 |
122 | GLT | 0.8913 |
123 | BE2 | 0.8913 |
124 | DGJ | 0.8911 |
125 | PAF | 0.8911 |
126 | SAL | 0.8908 |
127 | 293 | 0.8904 |
128 | DBH | 0.8901 |
129 | MA3 | 0.8900 |
130 | GCV | 0.8900 |
131 | HIO | 0.8900 |
132 | AOS | 0.8899 |
133 | ISD | 0.8897 |
134 | OA3 | 0.8896 |
135 | FBV | 0.8896 |
136 | ADE | 0.8896 |
137 | FUB | 0.8888 |
138 | KFH | 0.8885 |
139 | DFU | 0.8883 |
140 | RUU | 0.8881 |
141 | 1LN | 0.8879 |
142 | VNJ | 0.8879 |
143 | FLC | 0.8879 |
144 | CIT | 0.8879 |
145 | DFB | 0.8878 |
146 | 3DY | 0.8876 |
147 | 6M4 | 0.8872 |
148 | 7B4 | 0.8870 |
149 | HPA | 0.8869 |
150 | SHG | 0.8868 |
151 | FSW | 0.8867 |
152 | K5W | 0.8866 |
153 | LYL | 0.8864 |
154 | EXO | 0.8862 |
155 | AGK | 0.8862 |
156 | RPQ | 0.8859 |
157 | 2ZV | 0.8857 |
158 | 2H5 | 0.8857 |
159 | KP6 | 0.8854 |
160 | 25W | 0.8852 |
161 | 4AA | 0.8852 |
162 | 82I | 0.8851 |
163 | UEG | 0.8851 |
164 | AHR | 0.8851 |
165 | HHA | 0.8850 |
166 | 1GN | 0.8849 |
167 | GTZ | 0.8849 |
168 | IPM | 0.8849 |
169 | GT0 | 0.8846 |
170 | 3IT | 0.8845 |
171 | PAV | 0.8843 |
172 | G6D | 0.8841 |
173 | T9G | 0.8839 |
174 | OAF | 0.8837 |
175 | NTM | 0.8837 |
176 | IPZ | 0.8836 |
177 | GIF | 0.8835 |
178 | YIO | 0.8835 |
179 | G8M | 0.8833 |
180 | 4RW | 0.8831 |
181 | 9PY | 0.8831 |
182 | 260 | 0.8830 |
183 | 8EZ | 0.8830 |
184 | KPL | 0.8828 |
185 | SYG | 0.8827 |
186 | MVL | 0.8827 |
187 | FPK | 0.8826 |
188 | BCU | 0.8822 |
189 | RHU | 0.8821 |
190 | GOG | 0.8820 |
191 | BFM | 0.8819 |
192 | YTB | 0.8818 |
193 | HA7 | 0.8817 |
194 | FA6 | 0.8814 |
195 | ZB1 | 0.8813 |
196 | FB1 | 0.8812 |
197 | JKE | 0.8810 |
198 | GCB | 0.8807 |
199 | CBF | 0.8797 |
200 | ENL | 0.8796 |
201 | BTE | 0.8796 |
202 | KDF | 0.8795 |
203 | EKZ | 0.8792 |
204 | SJ5 | 0.8789 |
205 | FDK | 0.8788 |
206 | RIB | 0.8788 |
207 | ROR | 0.8787 |
208 | DQA | 0.8787 |
209 | TAR | 0.8786 |
210 | MFB | 0.8786 |
211 | CTL | 0.8785 |
212 | PTO | 0.8785 |
213 | AH8 | 0.8781 |
214 | DQN | 0.8781 |
215 | FHN | 0.8778 |
216 | GOO | 0.8778 |
217 | 5WX | 0.8776 |
218 | NTZ | 0.8774 |
219 | GCO | 0.8773 |
220 | N7P | 0.8773 |
221 | FX1 | 0.8772 |
222 | XLS | 0.8768 |
223 | SVD | 0.8768 |
224 | JZ4 | 0.8767 |
225 | GOX | 0.8767 |
226 | F34 | 0.8766 |
227 | FOT | 0.8765 |
228 | 2XX | 0.8764 |
229 | CN0 | 0.8763 |
230 | XUL | 0.8761 |
231 | FH2 | 0.8761 |
232 | KJY | 0.8759 |
233 | PXM | 0.8757 |
234 | 1LQ | 0.8756 |
235 | Q6T | 0.8756 |
236 | TAG | 0.8746 |
237 | IP0 | 0.8746 |
238 | 2ZQ | 0.8744 |
239 | DBX | 0.8743 |
240 | 2GS | 0.8742 |
241 | DHQ | 0.8739 |
242 | 2EC | 0.8738 |
243 | REL | 0.8736 |
244 | KOJ | 0.8736 |
245 | PRZ | 0.8735 |
246 | 39A | 0.8735 |
247 | KLW | 0.8732 |
248 | 1U6 | 0.8730 |
249 | ASN | 0.8728 |
250 | HFB | 0.8726 |
251 | MT5 | 0.8725 |
252 | PHT | 0.8723 |
253 | ES6 | 0.8722 |
254 | 2M5 | 0.8721 |
255 | ALL | 0.8719 |
256 | AKH | 0.8716 |
257 | DOR | 0.8713 |
258 | GTL | 0.8708 |
259 | 3C2 | 0.8703 |
260 | MSN | 0.8702 |
261 | BNT | 0.8701 |
262 | 2LP | 0.8701 |
263 | GLY PRO | 0.8699 |
264 | 289 | 0.8699 |
265 | MZB | 0.8697 |
266 | 2CL | 0.8695 |
267 | N8P | 0.8692 |
268 | IJZ | 0.8692 |
269 | B53 | 0.8691 |
270 | 3V4 | 0.8691 |
271 | 5RG | 0.8690 |
272 | GIO | 0.8689 |
273 | ZWZ | 0.8688 |
274 | XM0 | 0.8687 |
275 | 3DM | 0.8686 |
276 | 3R9 | 0.8683 |
277 | 5CU | 0.8682 |
278 | 23J | 0.8681 |
279 | DOB | 0.8680 |
280 | 34V | 0.8680 |
281 | FA0 | 0.8679 |
282 | 24B | 0.8676 |
283 | DMV | 0.8673 |
284 | 091 | 0.8672 |
285 | H6B | 0.8671 |
286 | ABE | 0.8671 |
287 | IPB | 0.8668 |
288 | NGO | 0.8668 |
289 | JZ3 | 0.8666 |
290 | 4M0 | 0.8665 |
291 | GTR | 0.8661 |
292 | MWP | 0.8660 |
293 | PEP | 0.8658 |
294 | GTQ | 0.8656 |
295 | NK1 | 0.8655 |
296 | 3C1 | 0.8655 |
297 | DIE | 0.8653 |
298 | NGT | 0.8650 |
299 | NGW | 0.8650 |
300 | KBB | 0.8650 |
301 | PSJ | 0.8649 |
302 | 9TZ | 0.8647 |
303 | EVA | 0.8646 |
304 | EYK | 0.8638 |
305 | F1A | 0.8637 |
306 | 4P0 | 0.8635 |
307 | 4NC | 0.8634 |
308 | 54G | 0.8633 |
309 | 4TE | 0.8632 |
310 | GIM | 0.8631 |
311 | 5FN | 0.8631 |
312 | 5M0 | 0.8629 |
313 | 7VS | 0.8624 |
314 | 2FT | 0.8621 |
315 | F5B | 0.8621 |
316 | R8A | 0.8617 |
317 | EMZ | 0.8615 |
318 | BDR | 0.8613 |
319 | Z6J | 0.8611 |
320 | HTP | 0.8611 |
321 | 0LH | 0.8605 |
322 | OAA | 0.8604 |
323 | 0W8 | 0.8604 |
324 | KIA | 0.8603 |
325 | LDU | 0.8601 |
326 | IT9 | 0.8593 |
327 | HLZ | 0.8590 |
328 | C2U | 0.8590 |
329 | TFU | 0.8588 |
330 | RXR | 0.8588 |
331 | GLG | 0.8586 |
332 | IUP | 0.8583 |
333 | RBL | 0.8583 |
334 | NMJ | 0.8574 |
335 | M3S | 0.8573 |
336 | URQ | 0.8573 |
337 | 24W | 0.8572 |
338 | 3DO | 0.8565 |
339 | 3OC | 0.8563 |
340 | 3XX | 0.8556 |
341 | 92K | 0.8555 |
342 | JZ1 | 0.8527 |
343 | GDL | 0.8520 |
344 | 6CS | 0.8514 |
345 | 7VJ | 0.8510 |
346 | 4VY | 0.8508 |
This union binding pocket(no: 1) in the query (biounit: 4w93.bio1) has 33 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |