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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 1331 families. | |||||
1 | 5II1 | - | 6BL | C11 H8 N2 O2 | Cc1c-2c([n.... |
2 | 5HRV | - | 64C | C12 H10 N2 O2 | CCc1c-2c([.... |
3 | 3MB4 | - | MB3 | C5 H9 N O | CN1CCCC1=O |
4 | 5FH6 | - | 5XM | C17 H21 N3 O | c1ccc2c(c1.... |
5 | 5II2 | - | LU2 | C15 H10 O6 | c1cc(c(cc1.... |
6 | 5FH8 | Kd = 170 nM | 5XK | C17 H19 Cl N2 O | CCC(CC)Cc1.... |
7 | 5IID | - | 6BK | C15 H10 O5 | c1cc(c2c(c.... |
8 | 5HRW | - | 64E | C13 H12 N2 O2 | CCCc1c-2c(.... |
9 | 5HRX | - | 64F | C14 H14 N2 O2 | CCCCc1c-2c.... |
10 | 5FH7 | Kd = 137 nM | 5XL | C14 H14 Cl N3 O | CN(C)Cc1cc.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 1144 families. | |||||
1 | 5II1 | - | 6BL | C11 H8 N2 O2 | Cc1c-2c([n.... |
2 | 5HRV | - | 64C | C12 H10 N2 O2 | CCc1c-2c([.... |
3 | 3MB4 | - | MB3 | C5 H9 N O | CN1CCCC1=O |
4 | 5FH6 | - | 5XM | C17 H21 N3 O | c1ccc2c(c1.... |
5 | 5II2 | - | LU2 | C15 H10 O6 | c1cc(c(cc1.... |
6 | 5FH8 | Kd = 170 nM | 5XK | C17 H19 Cl N2 O | CCC(CC)Cc1.... |
7 | 5IID | - | 6BK | C15 H10 O5 | c1cc(c2c(c.... |
8 | 5HRW | - | 64E | C13 H12 N2 O2 | CCCc1c-2c(.... |
9 | 5HRX | - | 64F | C14 H14 N2 O2 | CCCCc1c-2c.... |
10 | 5FH7 | Kd = 137 nM | 5XL | C14 H14 Cl N3 O | CN(C)Cc1cc.... |
11 | 6HAZ | - | FX5 | C14 H18 N5 O | c1ccc(c(c1.... |
12 | 3UVD | - | MB3 | C5 H9 N O | CN1CCCC1=O |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | X8D | 0.9657 |
2 | 28N | 0.9531 |
3 | LDR | 0.9481 |
4 | R6T | 0.9480 |
5 | 9AP | 0.9469 |
6 | 774 | 0.9437 |
7 | 30G | 0.9432 |
8 | 1QP | 0.9430 |
9 | EYA | 0.9407 |
10 | EYM | 0.9400 |
11 | C9E | 0.9384 |
12 | 2LY | 0.9344 |
13 | 4VS | 0.9328 |
14 | 7FF | 0.9305 |
15 | XM5 | 0.9288 |
16 | 0XT | 0.9284 |
17 | 8XQ | 0.9269 |
18 | FLV | 0.9264 |
19 | 226 | 0.9264 |
20 | C2Y | 0.9253 |
21 | 3N4 | 0.9250 |
22 | 5VJ | 0.9250 |
23 | TOF | 0.9227 |
24 | 7I2 | 0.9226 |
25 | 4KL | 0.9221 |
26 | 4AN | 0.9220 |
27 | HNQ | 0.9215 |
28 | 5WY | 0.9214 |
29 | E7R | 0.9213 |
30 | 3J8 | 0.9201 |
31 | 92P | 0.9201 |
32 | UFO | 0.9201 |
33 | PEY | 0.9200 |
34 | 582 | 0.9191 |
35 | 7B3 | 0.9185 |
36 | 2FQ | 0.9161 |
37 | NTZ | 0.9157 |
38 | MT8 | 0.9144 |
39 | I6G | 0.9142 |
40 | 4ME | 0.9131 |
41 | 7ZE | 0.9127 |
42 | MUA | 0.9121 |
43 | DNC | 0.9118 |
44 | GCW | 0.9113 |
45 | BPU | 0.9113 |
46 | 6X9 | 0.9106 |
47 | UAN | 0.9104 |
48 | JR2 | 0.9101 |
49 | QPR | 0.9099 |
50 | F2W | 0.9093 |
51 | B60 | 0.9082 |
52 | DPZ | 0.9074 |
53 | ZME | 0.9074 |
54 | FBG | 0.9073 |
55 | TIY | 0.9068 |
56 | 5V7 | 0.9066 |
57 | M6Z | 0.9065 |
58 | CCV | 0.9061 |
59 | G12 | 0.9055 |
60 | BDP | 0.9054 |
61 | RXA | 0.9054 |
62 | IBM | 0.9052 |
63 | MYI | 0.9050 |
64 | 537 | 0.9049 |
65 | Z5P | 0.9046 |
66 | DNA | 0.9046 |
67 | SYA | 0.9044 |
68 | SRO | 0.9044 |
69 | ZYR | 0.9042 |
70 | MAQ | 0.9038 |
71 | 2ZQ | 0.9033 |
72 | TQU | 0.9025 |
73 | Q7A | 0.9022 |
74 | 1X7 | 0.9021 |
75 | JTA | 0.9016 |
76 | DBF | 0.9015 |
77 | GNV | 0.9013 |
78 | 9FE | 0.9011 |
79 | II4 | 0.9010 |
80 | QNA | 0.9010 |
81 | JY4 | 0.9007 |
82 | ONZ | 0.9004 |
83 | NID | 0.9000 |
84 | DNF | 0.8999 |
85 | 18N | 0.8995 |
86 | 5NS | 0.8991 |
87 | 2JK | 0.8990 |
88 | H5B | 0.8987 |
89 | 1KP | 0.8983 |
90 | FXH | 0.8983 |
91 | Q6T | 0.8979 |
92 | KYA | 0.8978 |
93 | CFF | 0.8977 |
94 | N8Y | 0.8976 |
95 | T28 | 0.8975 |
96 | QX4 | 0.8975 |
97 | ONR | 0.8972 |
98 | 37T | 0.8970 |
99 | 2D3 | 0.8966 |
100 | X11 | 0.8966 |
101 | BA5 | 0.8966 |
102 | 9KT | 0.8964 |
103 | PDC | 0.8963 |
104 | 4MU | 0.8963 |
105 | HA5 | 0.8962 |
106 | 5VL | 0.8961 |
107 | W8G | 0.8959 |
108 | LI6 | 0.8957 |
109 | 39O | 0.8956 |
110 | NQ | 0.8951 |
111 | 9MG | 0.8950 |
112 | 2AK | 0.8949 |
113 | AJV | 0.8948 |
114 | BK9 | 0.8947 |
115 | DRG | 0.8942 |
116 | VYM | 0.8941 |
117 | INE | 0.8940 |
118 | CB1 | 0.8939 |
119 | RZH | 0.8938 |
120 | HLD | 0.8937 |
121 | 55D | 0.8936 |
122 | HHR | 0.8936 |
123 | VK3 | 0.8935 |
124 | APZ | 0.8934 |
125 | NCV | 0.8934 |
126 | 8VE | 0.8932 |
127 | 8G6 | 0.8931 |
128 | JP2 | 0.8929 |
129 | EGR | 0.8929 |
130 | MHK | 0.8928 |
131 | HWH | 0.8928 |
132 | PH2 | 0.8925 |
133 | CKA | 0.8923 |
134 | ASE | 0.8923 |
135 | 0FO | 0.8923 |
136 | VXX | 0.8923 |
137 | AKH | 0.8918 |
138 | 0GZ | 0.8918 |
139 | MT5 | 0.8918 |
140 | DK1 | 0.8915 |
141 | Q77 | 0.8913 |
142 | M5H | 0.8912 |
143 | F12 | 0.8911 |
144 | 0F9 | 0.8910 |
145 | MVN | 0.8908 |
146 | PYQ | 0.8904 |
147 | 5PX | 0.8901 |
148 | 2J9 | 0.8900 |
149 | 8W9 | 0.8900 |
150 | K68 | 0.8895 |
151 | 9UL | 0.8893 |
152 | TNF | 0.8893 |
153 | CLZ | 0.8890 |
154 | B21 | 0.8887 |
155 | 6ME | 0.8886 |
156 | GCB | 0.8881 |
157 | 28S | 0.8881 |
158 | ROI | 0.8877 |
159 | MNX | 0.8877 |
160 | 0N7 | 0.8876 |
161 | UNC | 0.8876 |
162 | MXX | 0.8875 |
163 | 3IT | 0.8874 |
164 | ZVO | 0.8873 |
165 | HKD | 0.8873 |
166 | KIF | 0.8872 |
167 | 0FK | 0.8872 |
168 | NVU | 0.8871 |
169 | EVA | 0.8870 |
170 | AY4 | 0.8870 |
171 | M2K | 0.8869 |
172 | XHP | 0.8866 |
173 | B62 | 0.8866 |
174 | GHM | 0.8865 |
175 | 44V | 0.8865 |
176 | HQD | 0.8864 |
177 | TRP | 0.8861 |
178 | KFH | 0.8860 |
179 | 1X8 | 0.8860 |
180 | 8HC | 0.8860 |
181 | LZ2 | 0.8859 |
182 | 7CT | 0.8859 |
183 | V1T | 0.8859 |
184 | 8GK | 0.8858 |
185 | AA | 0.8858 |
186 | BEA | 0.8858 |
187 | XQK | 0.8856 |
188 | 42C | 0.8856 |
189 | AJY | 0.8855 |
190 | EY7 | 0.8855 |
191 | M1H | 0.8852 |
192 | MVL | 0.8847 |
193 | MUR | 0.8847 |
194 | ETV | 0.8847 |
195 | OTW | 0.8845 |
196 | 209 | 0.8845 |
197 | RD4 | 0.8844 |
198 | GNJ | 0.8842 |
199 | ICO | 0.8842 |
200 | NDM | 0.8841 |
201 | 4XY | 0.8840 |
202 | D07 | 0.8839 |
203 | 3Z8 | 0.8839 |
204 | JYB | 0.8837 |
205 | H33 | 0.8837 |
206 | DBJ | 0.8836 |
207 | XFE | 0.8834 |
208 | 5WU | 0.8834 |
209 | 67X | 0.8830 |
210 | AZ9 | 0.8829 |
211 | DX3 | 0.8829 |
212 | TNL | 0.8825 |
213 | 7ZC | 0.8823 |
214 | CK2 | 0.8823 |
215 | FOT | 0.8822 |
216 | 2SX | 0.8822 |
217 | JG8 | 0.8819 |
218 | 7NI | 0.8819 |
219 | 5OF | 0.8818 |
220 | DPT | 0.8818 |
221 | CKU | 0.8817 |
222 | 96U | 0.8816 |
223 | 7M6 | 0.8816 |
224 | SYR | 0.8814 |
225 | M0Q | 0.8813 |
226 | X0W | 0.8813 |
227 | THA | 0.8813 |
228 | PRF | 0.8812 |
229 | THM | 0.8812 |
230 | BGC | 0.8812 |
231 | CWS | 0.8810 |
232 | KUF | 0.8807 |
233 | KJY | 0.8806 |
234 | 7VS | 0.8806 |
235 | 8MO | 0.8804 |
236 | EA1 | 0.8804 |
237 | C2U | 0.8804 |
238 | 44W | 0.8803 |
239 | GCU | 0.8803 |
240 | 54X | 0.8802 |
241 | DQU | 0.8802 |
242 | HHS | 0.8801 |
243 | H7Y | 0.8800 |
244 | 5WX | 0.8799 |
245 | 878 | 0.8795 |
246 | 7MX | 0.8794 |
247 | 2K8 | 0.8793 |
248 | 1U6 | 0.8792 |
249 | HLZ | 0.8791 |
250 | IPT | 0.8791 |
251 | GNM | 0.8791 |
252 | 5NE | 0.8790 |
253 | 12B | 0.8789 |
254 | AIN | 0.8788 |
255 | NAG | 0.8787 |
256 | 0P6 | 0.8787 |
257 | FE DB1 | 0.8785 |
258 | QMS | 0.8784 |
259 | E35 | 0.8784 |
260 | TWO | 0.8780 |
261 | B56 | 0.8778 |
262 | 4TU | 0.8777 |
263 | PHH | 0.8777 |
264 | K3Q | 0.8776 |
265 | 5RN | 0.8776 |
266 | Q24 | 0.8775 |
267 | 1A7 | 0.8773 |
268 | GIM | 0.8772 |
269 | 8WZ | 0.8772 |
270 | 7WR | 0.8772 |
271 | 06B | 0.8770 |
272 | JKZ | 0.8765 |
273 | CH9 | 0.8764 |
274 | 8CM | 0.8764 |
275 | PD2 | 0.8763 |
276 | 4NO | 0.8760 |
277 | G3F | 0.8760 |
278 | L7T | 0.8755 |
279 | 4HC | 0.8755 |
280 | OA3 | 0.8753 |
281 | IJZ | 0.8751 |
282 | ANF | 0.8747 |
283 | 8S0 | 0.8747 |
284 | Z73 | 0.8745 |
285 | JUO | 0.8745 |
286 | AC2 | 0.8744 |
287 | Q71 | 0.8743 |
288 | PX7 | 0.8742 |
289 | JUG | 0.8741 |
290 | 12Q | 0.8741 |
291 | M0W | 0.8739 |
292 | 8DA | 0.8739 |
293 | GCS | 0.8739 |
294 | 680 | 0.8737 |
295 | MB1 | 0.8737 |
296 | OTD | 0.8737 |
297 | K6X | 0.8736 |
298 | 372 | 0.8735 |
299 | O2A | 0.8734 |
300 | GLC | 0.8734 |
301 | GOX | 0.8732 |
302 | M1Q | 0.8731 |
303 | KGK | 0.8730 |
304 | VNL | 0.8729 |
305 | KDO | 0.8728 |
306 | E1K | 0.8724 |
307 | GV9 | 0.8724 |
308 | FDR | 0.8723 |
309 | 1HN | 0.8723 |
310 | KT7 | 0.8723 |
311 | NLA | 0.8722 |
312 | AO6 | 0.8722 |
313 | K44 | 0.8721 |
314 | RH1 | 0.8720 |
315 | 6VD | 0.8719 |
316 | IOS | 0.8718 |
317 | 6R8 | 0.8718 |
318 | AJ2 | 0.8714 |
319 | TEP | 0.8713 |
320 | AQO | 0.8713 |
321 | 9FL | 0.8713 |
322 | BZJ | 0.8713 |
323 | 5QX | 0.8712 |
324 | JU2 | 0.8711 |
325 | 6QF | 0.8709 |
326 | 3MG | 0.8709 |
327 | I7B | 0.8707 |
328 | TTL | 0.8705 |
329 | 2O6 | 0.8705 |
330 | 5RO | 0.8705 |
331 | UQ | 0.8704 |
332 | AZ8 | 0.8703 |
333 | DTR | 0.8702 |
334 | 3TJ | 0.8701 |
335 | 3C1 | 0.8700 |
336 | 1YE | 0.8700 |
337 | DHQ | 0.8696 |
338 | TXQ | 0.8695 |
339 | GAL | 0.8695 |
340 | GTR | 0.8694 |
341 | JAK | 0.8694 |
342 | ESI | 0.8692 |
343 | 3Y7 | 0.8690 |
344 | PJW | 0.8690 |
345 | RB2 | 0.8689 |
346 | HJP | 0.8688 |
347 | TTY | 0.8684 |
348 | 4Z4 | 0.8681 |
349 | H7S | 0.8677 |
350 | M6N | 0.8677 |
351 | CTS | 0.8677 |
352 | G1O | 0.8677 |
353 | AEZ | 0.8676 |
354 | 4A5 | 0.8675 |
355 | HQT | 0.8673 |
356 | 1IT | 0.8673 |
357 | GJP | 0.8673 |
358 | M5K | 0.8672 |
359 | 20J | 0.8672 |
360 | PQK | 0.8671 |
361 | 495 | 0.8670 |
362 | 7ME | 0.8670 |
363 | GDE | 0.8667 |
364 | MNY | 0.8665 |
365 | URC | 0.8663 |
366 | 9CA | 0.8662 |
367 | WUB | 0.8655 |
368 | EOL | 0.8649 |
369 | EJZ | 0.8649 |
370 | DX1 | 0.8648 |
371 | ANC | 0.8647 |
372 | DW5 | 0.8647 |
373 | I7C | 0.8646 |
374 | 15N | 0.8646 |
375 | 0JD | 0.8645 |
376 | JXW | 0.8645 |
377 | SKA | 0.8644 |
378 | MEW | 0.8644 |
379 | PE0 | 0.8643 |
380 | LGC | 0.8642 |
381 | HZQ | 0.8641 |
382 | YSO | 0.8641 |
383 | 692 | 0.8640 |
384 | PXL | 0.8640 |
385 | H70 | 0.8640 |
386 | GO1 | 0.8639 |
387 | 344 | 0.8639 |
388 | UXH | 0.8638 |
389 | 97T | 0.8638 |
390 | KJH | 0.8637 |
391 | 15E | 0.8637 |
392 | DIN | 0.8635 |
393 | J9Q | 0.8631 |
394 | 5MD | 0.8629 |
395 | 6E8 | 0.8629 |
396 | 0W8 | 0.8626 |
397 | APS | 0.8625 |
398 | SG2 | 0.8621 |
399 | ALR | 0.8619 |
400 | MRW | 0.8618 |
401 | B0K | 0.8618 |
402 | 4RU | 0.8614 |
403 | JXN | 0.8613 |
404 | DUR | 0.8612 |
405 | P9I | 0.8612 |
406 | MT0 | 0.8611 |
407 | 8WT | 0.8608 |
408 | DIU | 0.8608 |
409 | K22 | 0.8606 |
410 | 32X | 0.8604 |
411 | A7W | 0.8603 |
412 | BIO | 0.8602 |
413 | GOE | 0.8600 |
414 | GNY | 0.8597 |
415 | G1P | 0.8596 |
416 | BNT | 0.8594 |
417 | SOR | 0.8592 |
418 | GRI | 0.8590 |
419 | BIK | 0.8588 |
420 | KY3 | 0.8586 |
421 | 7W1 | 0.8584 |
422 | TT4 | 0.8584 |
423 | EVO | 0.8580 |
424 | KJU | 0.8579 |
425 | DRL | 0.8576 |
426 | 5MK | 0.8571 |
427 | 2HQ | 0.8562 |
428 | 5TY | 0.8561 |
429 | K37 | 0.8558 |
430 | N0Z | 0.8558 |
431 | 3NY | 0.8555 |
432 | BPY | 0.8550 |
433 | DHK | 0.8548 |
434 | K32 | 0.8544 |
435 | 86J | 0.8543 |
436 | E1T | 0.8538 |
437 | XAZ | 0.8537 |
438 | 4B0 | 0.8535 |
439 | GO0 | 0.8531 |
This union binding pocket(no: 1) in the query (biounit: 5fh7.bio2) has 16 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 5fh7.bio1) has 15 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |