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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 | 6W4Y | - | 7ZW | C16 H18 F3 N3 O3 | CC(C)C[C@@.... |
2 | 6MG5 | Kd = 20.3 uM | 6ZW | C14 H17 N O2 | CCN(CC)c1c.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 1144 families. | |||||
1 | 6W4Y | - | 7ZW | C16 H18 F3 N3 O3 | CC(C)C[C@@.... |
2 | 6MG5 | Kd = 20.3 uM | 6ZW | C14 H17 N O2 | CCN(CC)c1c.... |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | JP2 | 0.9518 |
2 | 2JK | 0.9358 |
3 | DBS | 0.9276 |
4 | 57D | 0.9271 |
5 | N2M | 0.9255 |
6 | DK1 | 0.9252 |
7 | CNI | 0.9251 |
8 | H7S | 0.9237 |
9 | YE7 | 0.9208 |
10 | N1E | 0.9198 |
11 | GNG | 0.9198 |
12 | FQX | 0.9197 |
13 | 5GT | 0.9183 |
14 | B21 | 0.9181 |
15 | H70 | 0.9173 |
16 | 4L2 | 0.9173 |
17 | V1T | 0.9165 |
18 | 3JC | 0.9156 |
19 | HRM | 0.9145 |
20 | 5TY | 0.9137 |
21 | GA2 | 0.9132 |
22 | YE6 | 0.9114 |
23 | DNQ | 0.9102 |
24 | CL9 | 0.9100 |
25 | NRA | 0.9097 |
26 | DPT | 0.9095 |
27 | BGU | 0.9086 |
28 | NIY | 0.9082 |
29 | JWS | 0.9081 |
30 | S60 | 0.9079 |
31 | 3L1 | 0.9077 |
32 | JY4 | 0.9076 |
33 | 3RP | 0.9074 |
34 | WUB | 0.9070 |
35 | BQ2 | 0.9069 |
36 | LUM | 0.9069 |
37 | FCD | 0.9068 |
38 | B4O | 0.9067 |
39 | X2M | 0.9063 |
40 | II4 | 0.9055 |
41 | GNM | 0.9052 |
42 | SG2 | 0.9051 |
43 | KLV | 0.9049 |
44 | GDL | 0.9048 |
45 | AJ4 | 0.9048 |
46 | SKF | 0.9048 |
47 | JTA | 0.9048 |
48 | HBO | 0.9047 |
49 | MUX | 0.9044 |
50 | BIK | 0.9043 |
51 | BZE | 0.9042 |
52 | 6QF | 0.9040 |
53 | ANC | 0.9037 |
54 | 2J1 | 0.9036 |
55 | GNV | 0.9033 |
56 | 7I2 | 0.9030 |
57 | 6FB | 0.9028 |
58 | AH9 | 0.9027 |
59 | X0T | 0.9026 |
60 | Q11 | 0.9026 |
61 | IL5 | 0.9026 |
62 | CUT | 0.9026 |
63 | 7D7 | 0.9025 |
64 | S98 | 0.9025 |
65 | AVX | 0.9022 |
66 | 4GU | 0.9015 |
67 | 5E5 | 0.9014 |
68 | 3D1 | 0.9010 |
69 | 5SJ | 0.9009 |
70 | 0SY | 0.9009 |
71 | GL6 | 0.9007 |
72 | 5WT | 0.9007 |
73 | 1ZC | 0.9006 |
74 | CZ0 | 0.9001 |
75 | 78Y | 0.9001 |
76 | DCF | 0.9000 |
77 | F5C | 0.8997 |
78 | NAG | 0.8991 |
79 | ZHA | 0.8990 |
80 | AJY | 0.8990 |
81 | SLS | 0.8989 |
82 | MBP | 0.8988 |
83 | CKA | 0.8988 |
84 | 9ZE | 0.8987 |
85 | CTE | 0.8986 |
86 | 78P | 0.8983 |
87 | 2GD | 0.8980 |
88 | AH6 | 0.8977 |
89 | Y3L | 0.8977 |
90 | 4XF | 0.8973 |
91 | EV2 | 0.8970 |
92 | ITE | 0.8969 |
93 | 4FF | 0.8967 |
94 | 5F1 | 0.8966 |
95 | 47V | 0.8966 |
96 | G6P | 0.8965 |
97 | BG6 | 0.8965 |
98 | ZYV | 0.8963 |
99 | KWB | 0.8960 |
100 | 1FE | 0.8956 |
101 | F2W | 0.8955 |
102 | PE2 | 0.8955 |
103 | X11 | 0.8954 |
104 | 3VX | 0.8954 |
105 | ZRK | 0.8954 |
106 | FF2 | 0.8951 |
107 | DT7 | 0.8951 |
108 | 28A | 0.8945 |
109 | 3WL | 0.8944 |
110 | OX2 | 0.8942 |
111 | 0DN | 0.8942 |
112 | H4B | 0.8942 |
113 | 4R1 | 0.8940 |
114 | 2WU | 0.8940 |
115 | 8HG | 0.8940 |
116 | 0JD | 0.8939 |
117 | BZJ | 0.8939 |
118 | XYP XDN | 0.8937 |
119 | ET0 | 0.8935 |
120 | 344 | 0.8934 |
121 | 4G2 | 0.8934 |
122 | QIV | 0.8933 |
123 | HA5 | 0.8932 |
124 | E1T | 0.8931 |
125 | 8NB | 0.8931 |
126 | 2FA | 0.8927 |
127 | CDY | 0.8925 |
128 | J38 | 0.8924 |
129 | THM | 0.8924 |
130 | 4I8 | 0.8922 |
131 | 5AD | 0.8922 |
132 | TXW | 0.8921 |
133 | GZV | 0.8920 |
134 | L3L | 0.8919 |
135 | UKV | 0.8915 |
136 | 0GA | 0.8912 |
137 | ZYQ | 0.8912 |
138 | 6TJ | 0.8911 |
139 | 8NX | 0.8911 |
140 | 30G | 0.8911 |
141 | FER | 0.8911 |
142 | 6HP | 0.8911 |
143 | 3J8 | 0.8910 |
144 | F40 | 0.8910 |
145 | 2GQ | 0.8909 |
146 | DXK | 0.8907 |
147 | GJP | 0.8905 |
148 | TCR | 0.8901 |
149 | CC6 | 0.8900 |
150 | MXD | 0.8898 |
151 | LL1 | 0.8897 |
152 | W29 | 0.8896 |
153 | CUH | 0.8896 |
154 | MUR | 0.8894 |
155 | CSN | 0.8894 |
156 | GNY | 0.8893 |
157 | JRO | 0.8893 |
158 | L22 | 0.8893 |
159 | IA2 | 0.8892 |
160 | 7L4 | 0.8891 |
161 | 1QV | 0.8889 |
162 | LFN | 0.8889 |
163 | 9CE | 0.8888 |
164 | JOV | 0.8887 |
165 | GO2 | 0.8886 |
166 | NE2 | 0.8885 |
167 | H2B | 0.8885 |
168 | 9UL | 0.8883 |
169 | LLT | 0.8881 |
170 | 0XT | 0.8881 |
171 | KF5 | 0.8880 |
172 | 4AB | 0.8880 |
173 | 5V7 | 0.8879 |
174 | 0FK | 0.8878 |
175 | AH3 | 0.8878 |
176 | HBI | 0.8876 |
177 | M3E | 0.8875 |
178 | 15N | 0.8874 |
179 | GMP | 0.8874 |
180 | 428 | 0.8870 |
181 | KYN | 0.8870 |
182 | HA6 | 0.8870 |
183 | L5D | 0.8870 |
184 | 6J3 | 0.8869 |
185 | IQ5 | 0.8868 |
186 | DX7 | 0.8867 |
187 | 5B2 | 0.8867 |
188 | 2D2 | 0.8867 |
189 | 28B | 0.8866 |
190 | 7AP | 0.8865 |
191 | QMS | 0.8865 |
192 | IAC | 0.8864 |
193 | 2P3 | 0.8864 |
194 | N91 | 0.8864 |
195 | TMG | 0.8863 |
196 | CC5 | 0.8862 |
197 | 1VK | 0.8862 |
198 | 774 | 0.8862 |
199 | Q4G | 0.8860 |
200 | IOS | 0.8858 |
201 | JCZ | 0.8858 |
202 | K97 | 0.8858 |
203 | THA | 0.8858 |
204 | 8HC | 0.8856 |
205 | TRP | 0.8855 |
206 | 2LW | 0.8855 |
207 | 3DT | 0.8854 |
208 | ZME | 0.8852 |
209 | 1DA | 0.8852 |
210 | 3AD | 0.8850 |
211 | BIO | 0.8850 |
212 | 0DF | 0.8849 |
213 | IQQ | 0.8848 |
214 | KMY | 0.8846 |
215 | 3Y7 | 0.8845 |
216 | 5F8 | 0.8845 |
217 | FY8 | 0.8843 |
218 | 27B | 0.8843 |
219 | ZRL | 0.8842 |
220 | EQA | 0.8841 |
221 | ANF | 0.8840 |
222 | XCG | 0.8839 |
223 | MIL | 0.8839 |
224 | 14Z | 0.8837 |
225 | PRL | 0.8835 |
226 | N0Z | 0.8835 |
227 | 5GV | 0.8833 |
228 | 2UD | 0.8833 |
229 | 6PB | 0.8832 |
230 | AC2 | 0.8831 |
231 | 363 | 0.8828 |
232 | 3D8 | 0.8828 |
233 | 7EH | 0.8828 |
234 | 5TZ | 0.8827 |
235 | 1HN | 0.8827 |
236 | 833 | 0.8826 |
237 | KYA | 0.8826 |
238 | 2J2 | 0.8825 |
239 | 9KZ | 0.8823 |
240 | ARP | 0.8823 |
241 | C0H | 0.8822 |
242 | 68A | 0.8821 |
243 | 2QV | 0.8821 |
244 | 4RU | 0.8819 |
245 | V2Z | 0.8819 |
246 | ARJ | 0.8818 |
247 | RSV | 0.8814 |
248 | APS | 0.8811 |
249 | 5WS | 0.8810 |
250 | XEV | 0.8810 |
251 | EXX | 0.8808 |
252 | BPU | 0.8807 |
253 | 2QU | 0.8805 |
254 | NDG | 0.8801 |
255 | BPY | 0.8801 |
256 | 5P3 | 0.8801 |
257 | 0W1 | 0.8799 |
258 | AA | 0.8798 |
259 | P4L | 0.8798 |
260 | WS7 | 0.8798 |
261 | DAH | 0.8797 |
262 | 2JX | 0.8797 |
263 | RKV | 0.8796 |
264 | X0U | 0.8796 |
265 | GLP | 0.8795 |
266 | GNJ | 0.8794 |
267 | AY4 | 0.8793 |
268 | ZSP | 0.8793 |
269 | K68 | 0.8791 |
270 | 3QV | 0.8790 |
271 | MR6 | 0.8790 |
272 | M78 | 0.8789 |
273 | 4F8 | 0.8788 |
274 | BA5 | 0.8788 |
275 | M5H | 0.8788 |
276 | NIR | 0.8788 |
277 | KTW | 0.8785 |
278 | DBF | 0.8785 |
279 | AJG | 0.8785 |
280 | HHS | 0.8783 |
281 | B4L | 0.8783 |
282 | 2O6 | 0.8782 |
283 | X48 | 0.8780 |
284 | 0OK | 0.8780 |
285 | 9JT | 0.8777 |
286 | DDC | 0.8776 |
287 | DT9 | 0.8776 |
288 | OCZ | 0.8775 |
289 | ZIQ | 0.8775 |
290 | P83 | 0.8774 |
291 | DUR | 0.8774 |
292 | K7H | 0.8773 |
293 | XIF XYP | 0.8772 |
294 | 51Y | 0.8772 |
295 | XYP XIF | 0.8770 |
296 | 6X9 | 0.8769 |
297 | PCQ | 0.8769 |
298 | LJ3 | 0.8769 |
299 | AN3 | 0.8769 |
300 | PMP | 0.8767 |
301 | 8XL | 0.8765 |
302 | ZEA | 0.8765 |
303 | DRG | 0.8763 |
304 | 22L | 0.8763 |
305 | JF8 | 0.8761 |
306 | 53X | 0.8761 |
307 | 5WK | 0.8760 |
308 | 4BL | 0.8759 |
309 | JVD | 0.8759 |
310 | 0J2 | 0.8758 |
311 | 3BH | 0.8757 |
312 | R9Y | 0.8756 |
313 | 6L6 | 0.8755 |
314 | 6JO | 0.8753 |
315 | B86 | 0.8750 |
316 | 1DR | 0.8750 |
317 | HRD | 0.8748 |
318 | BP7 | 0.8747 |
319 | XTS | 0.8747 |
320 | GHM | 0.8744 |
321 | SOV | 0.8744 |
322 | PLP | 0.8744 |
323 | JG8 | 0.8743 |
324 | TIA | 0.8743 |
325 | ELH | 0.8742 |
326 | DCZ | 0.8742 |
327 | AMR | 0.8741 |
328 | NWD | 0.8741 |
329 | 9F8 | 0.8738 |
330 | UN4 | 0.8738 |
331 | PIQ | 0.8737 |
332 | ADN | 0.8733 |
333 | Q5M | 0.8732 |
334 | KCH | 0.8732 |
335 | 0J4 | 0.8732 |
336 | WS6 | 0.8731 |
337 | A73 | 0.8729 |
338 | DNA | 0.8728 |
339 | 5FL | 0.8728 |
340 | G14 | 0.8727 |
341 | FYR | 0.8727 |
342 | 5E4 | 0.8727 |
343 | GO8 | 0.8727 |
344 | X0W | 0.8726 |
345 | QKU | 0.8724 |
346 | 108 | 0.8724 |
347 | IOP | 0.8723 |
348 | 55D | 0.8722 |
349 | NPX | 0.8722 |
350 | NCV | 0.8721 |
351 | 4BY | 0.8720 |
352 | AVA | 0.8719 |
353 | 1X8 | 0.8719 |
354 | 0UL | 0.8719 |
355 | 1A5 | 0.8718 |
356 | EVF | 0.8718 |
357 | AGI | 0.8717 |
358 | 0FR | 0.8715 |
359 | ESI | 0.8715 |
360 | 4KL | 0.8715 |
361 | A5H | 0.8714 |
362 | PEY | 0.8713 |
363 | XM5 | 0.8712 |
364 | 2K8 | 0.8712 |
365 | 39Z | 0.8711 |
366 | MAJ | 0.8711 |
367 | 5N5 | 0.8711 |
368 | JB8 | 0.8710 |
369 | KW8 | 0.8709 |
370 | MD6 | 0.8709 |
371 | 7ZL | 0.8708 |
372 | 9BF | 0.8707 |
373 | FHV | 0.8706 |
374 | 54X | 0.8706 |
375 | B23 | 0.8705 |
376 | TR4 | 0.8705 |
377 | 27M | 0.8705 |
378 | MNX | 0.8705 |
379 | THU | 0.8705 |
380 | E7S | 0.8704 |
381 | NQ7 | 0.8703 |
382 | JF2 | 0.8703 |
383 | MR4 | 0.8702 |
384 | LR2 | 0.8701 |
385 | QME | 0.8697 |
386 | D9Z | 0.8697 |
387 | AD3 | 0.8697 |
388 | 1V1 | 0.8695 |
389 | A | 0.8695 |
390 | G1P | 0.8694 |
391 | 6KT | 0.8693 |
392 | GJK | 0.8693 |
393 | P9E | 0.8693 |
394 | A5P | 0.8691 |
395 | 1F1 | 0.8689 |
396 | JF1 | 0.8688 |
397 | H5B | 0.8688 |
398 | ZZA | 0.8688 |
399 | 0LO | 0.8687 |
400 | C4E | 0.8686 |
401 | RVE | 0.8685 |
402 | D87 | 0.8685 |
403 | 5I5 | 0.8683 |
404 | FT6 | 0.8682 |
405 | HPR | 0.8682 |
406 | B98 | 0.8681 |
407 | MUK | 0.8681 |
408 | 19E | 0.8681 |
409 | 4V2 | 0.8680 |
410 | 4AU | 0.8680 |
411 | PRH | 0.8679 |
412 | BZC | 0.8679 |
413 | ESX | 0.8676 |
414 | S0D | 0.8676 |
415 | EXD | 0.8675 |
416 | PUR | 0.8674 |
417 | YZ9 | 0.8673 |
418 | LDC | 0.8673 |
419 | 8G6 | 0.8673 |
420 | 6DQ | 0.8673 |
421 | UA2 | 0.8672 |
422 | 4CN | 0.8672 |
423 | CH9 | 0.8671 |
424 | 1AJ | 0.8671 |
425 | Q9T | 0.8671 |
426 | 92O | 0.8671 |
427 | NEU | 0.8671 |
428 | BZQ | 0.8670 |
429 | VUP | 0.8669 |
430 | UFO | 0.8668 |
431 | 3ZB | 0.8668 |
432 | NAR | 0.8668 |
433 | EUE | 0.8667 |
434 | CK1 | 0.8667 |
435 | NE1 | 0.8666 |
436 | 6J9 | 0.8666 |
437 | 3DE | 0.8666 |
438 | IQZ | 0.8665 |
439 | 3VQ | 0.8665 |
440 | 1YL | 0.8665 |
441 | 2KU | 0.8665 |
442 | DHC | 0.8664 |
443 | S0E | 0.8664 |
444 | 9GP | 0.8664 |
445 | NKI | 0.8663 |
446 | IMH | 0.8662 |
447 | NEO | 0.8661 |
448 | 8HH | 0.8661 |
449 | P9I | 0.8658 |
450 | Z21 | 0.8658 |
451 | BHS | 0.8658 |
452 | 9FE | 0.8657 |
453 | 5NB | 0.8656 |
454 | 3R4 | 0.8654 |
455 | 2FX | 0.8654 |
456 | 5CD | 0.8653 |
457 | WV7 | 0.8652 |
458 | CR1 | 0.8650 |
459 | DFL | 0.8649 |
460 | A4D | 0.8648 |
461 | 8W9 | 0.8648 |
462 | JDN | 0.8647 |
463 | XG1 | 0.8647 |
464 | PPY | 0.8647 |
465 | NOS | 0.8646 |
466 | CX6 | 0.8646 |
467 | O9Q | 0.8644 |
468 | 7FU | 0.8644 |
469 | ZYW | 0.8643 |
470 | ESP | 0.8642 |
471 | 1A7 | 0.8641 |
472 | K25 | 0.8641 |
473 | UL1 | 0.8639 |
474 | WLH | 0.8638 |
475 | K44 | 0.8638 |
476 | 4I5 | 0.8638 |
477 | P80 | 0.8636 |
478 | XYA | 0.8635 |
479 | 5NN | 0.8635 |
480 | GZ2 | 0.8635 |
481 | TIY | 0.8635 |
482 | JGB | 0.8633 |
483 | 20D | 0.8632 |
484 | C9E | 0.8631 |
485 | 18E | 0.8629 |
486 | ALR | 0.8629 |
487 | VM1 | 0.8629 |
488 | 67Y | 0.8628 |
489 | DNF | 0.8627 |
490 | CCV | 0.8626 |
491 | FCW | 0.8626 |
492 | C09 | 0.8626 |
493 | GF4 | 0.8625 |
494 | 25F | 0.8625 |
495 | VCE | 0.8624 |
496 | MR5 | 0.8622 |
497 | 7O4 | 0.8622 |
498 | ZEC | 0.8622 |
499 | BBY | 0.8620 |
500 | NPS | 0.8620 |
501 | I2E | 0.8617 |
502 | XFE | 0.8617 |
503 | 6EN | 0.8615 |
504 | E1K | 0.8615 |
505 | JAW | 0.8614 |
506 | T1N | 0.8614 |
507 | EYY | 0.8614 |
508 | RGK | 0.8613 |
509 | IK1 | 0.8612 |
510 | 1V3 | 0.8612 |
511 | 5FD | 0.8611 |
512 | 3TC | 0.8611 |
513 | LEL | 0.8610 |
514 | CMG | 0.8610 |
515 | RFZ | 0.8609 |
516 | 5F5 | 0.8609 |
517 | MPP | 0.8606 |
518 | H35 | 0.8606 |
519 | G30 | 0.8605 |
520 | EAT | 0.8605 |
521 | XI7 | 0.8605 |
522 | 113 | 0.8603 |
523 | M1Z | 0.8603 |
524 | 6QT | 0.8600 |
525 | HFZ | 0.8600 |
526 | CX4 | 0.8597 |
527 | 0HO | 0.8597 |
528 | YEX | 0.8596 |
529 | RPP | 0.8593 |
530 | 5ID | 0.8591 |
531 | DDU | 0.8591 |
532 | 0HN | 0.8590 |
533 | L07 | 0.8589 |
534 | 3A9 | 0.8589 |
535 | 61M | 0.8587 |
536 | A5Q | 0.8587 |
537 | A9B | 0.8585 |
538 | MMJ | 0.8585 |
539 | VXX | 0.8584 |
540 | 15E | 0.8584 |
541 | BZ2 | 0.8584 |
542 | BGP | 0.8582 |
543 | 1KP | 0.8581 |
544 | IDZ | 0.8580 |
545 | 22T | 0.8579 |
546 | EWG | 0.8579 |
547 | HNT | 0.8578 |
548 | PVQ | 0.8578 |
549 | ZYR | 0.8577 |
550 | 9NB | 0.8575 |
551 | 5RP | 0.8574 |
552 | 1XS | 0.8573 |
553 | 64E | 0.8573 |
554 | TLF | 0.8573 |
555 | 1L5 | 0.8571 |
556 | 1HR | 0.8569 |
557 | URI | 0.8565 |
558 | 6NI | 0.8565 |
559 | 4NP | 0.8562 |
560 | SZ5 | 0.8559 |
561 | 4MU | 0.8556 |
562 | 6NT | 0.8553 |
563 | IPD | 0.8552 |
564 | M3F | 0.8551 |
565 | 4NO | 0.8550 |
566 | 0RY | 0.8546 |
567 | SU9 | 0.8546 |
568 | 2ZM | 0.8545 |
569 | RCV | 0.8544 |
570 | 3F4 | 0.8540 |
571 | PVK | 0.8539 |
572 | ICB | 0.8538 |
573 | 4ZF | 0.8533 |
574 | F31 | 0.8532 |
575 | 7G2 | 0.8524 |
576 | D3G | 0.8516 |
This union binding pocket(no: 1) in the query (biounit: 6mg5.bio1) has 16 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |