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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 | 3CL8 | - | 5AC | C4 H6 N4 O | c1[nH]c(c(.... |
2 | 3CL7 | - | HYN | C3 H4 N2 O2 | C1C(=O)NC(.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 1 families. | |||||
1 | 3CL8 | - | 5AC | C4 H6 N4 O | c1[nH]c(c(.... |
2 | 3CL7 | - | HYN | C3 H4 N2 O2 | C1C(=O)NC(.... |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | 25T | 1.0000 |
2 | XIX | 0.9992 |
3 | 24T | 0.9967 |
4 | CEJ | 0.9940 |
5 | DMG | 0.9866 |
6 | URA | 0.9843 |
7 | E60 | 0.9839 |
8 | IPH | 0.9831 |
9 | RCO | 0.9803 |
10 | CRS | 0.9801 |
11 | 7EX | 0.9799 |
12 | CYH | 0.9798 |
13 | LG3 | 0.9795 |
14 | CYT | 0.9793 |
15 | A2Q | 0.9788 |
16 | V1L | 0.9769 |
17 | 26D | 0.9768 |
18 | MBN | 0.9764 |
19 | C5J | 0.9763 |
20 | 1DH | 0.9761 |
21 | 3CH | 0.9758 |
22 | 9PO | 0.9749 |
23 | CXL | 0.9746 |
24 | BVF | 0.9740 |
25 | GOL | 0.9733 |
26 | LG5 | 0.9730 |
27 | 8GF | 0.9727 |
28 | 2AP | 0.9723 |
29 | MLI | 0.9719 |
30 | WOT | 0.9716 |
31 | HSL | 0.9714 |
32 | MLA | 0.9708 |
33 | MZ0 | 0.9708 |
34 | HPY | 0.9700 |
35 | 2IM | 0.9692 |
36 | HVK | 0.9692 |
37 | LGA | 0.9692 |
38 | HRZ | 0.9682 |
39 | 284 | 0.9676 |
40 | 3AP | 0.9671 |
41 | HGQ | 0.9670 |
42 | 3TR | 0.9663 |
43 | HOW | 0.9657 |
44 | 2AI | 0.9651 |
45 | 2MZ | 0.9648 |
46 | 4AP | 0.9645 |
47 | BAQ | 0.9643 |
48 | 4XX | 0.9641 |
49 | HAI | 0.9641 |
50 | 3MT | 0.9638 |
51 | GXE | 0.9626 |
52 | 4MZ | 0.9621 |
53 | GBL | 0.9620 |
54 | P2D | 0.9620 |
55 | 285 | 0.9615 |
56 | L60 | 0.9610 |
57 | MR3 | 0.9609 |
58 | 3ZQ | 0.9608 |
59 | 1MZ | 0.9607 |
60 | 280 | 0.9606 |
61 | 2KT | 0.9601 |
62 | 4JU | 0.9599 |
63 | MB3 | 0.9599 |
64 | CIG | 0.9599 |
65 | B3R | 0.9595 |
66 | 5MP | 0.9590 |
67 | DTI | 0.9589 |
68 | MMZ | 0.9581 |
69 | 8CL | 0.9578 |
70 | 1CB | 0.9574 |
71 | AMT | 0.9567 |
72 | HQE | 0.9567 |
73 | HEW | 0.9562 |
74 | H3M | 0.9560 |
75 | TMT | 0.9559 |
76 | 4H2 | 0.9558 |
77 | PCR | 0.9555 |
78 | LG4 | 0.9555 |
79 | HHN | 0.9554 |
80 | PIH | 0.9554 |
81 | M3T | 0.9550 |
82 | KSW | 0.9548 |
83 | DMI | 0.9547 |
84 | 5KX | 0.9545 |
85 | MLM | 0.9544 |
86 | DGY | 0.9542 |
87 | JZ6 | 0.9537 |
88 | MZY | 0.9536 |
89 | 25R | 0.9534 |
90 | TTO | 0.9530 |
91 | ES3 | 0.9526 |
92 | MEU | 0.9525 |
93 | PXY | 0.9525 |
94 | PLQ | 0.9522 |
95 | 93B | 0.9520 |
96 | 282 | 0.9510 |
97 | NVI | 0.9502 |
98 | CAQ | 0.9502 |
99 | 40O | 0.9501 |
100 | 3GR | 0.9495 |
101 | BYZ | 0.9490 |
102 | DA1 | 0.9488 |
103 | FPN | 0.9485 |
104 | MMU | 0.9481 |
105 | L89 | 0.9479 |
106 | 2MH | 0.9479 |
107 | HGW | 0.9478 |
108 | 3ZS | 0.9475 |
109 | SER | 0.9471 |
110 | TMZ | 0.9471 |
111 | OXL | 0.9470 |
112 | OHG | 0.9469 |
113 | IDH | 0.9468 |
114 | HIU | 0.9467 |
115 | OXM | 0.9465 |
116 | RSF | 0.9462 |
117 | BML | 0.9455 |
118 | 4AX | 0.9450 |
119 | HHQ | 0.9449 |
120 | DSN | 0.9438 |
121 | 4HS | 0.9434 |
122 | 1AN | 0.9433 |
123 | DXX | 0.9423 |
124 | 76X | 0.9416 |
125 | ATQ | 0.9414 |
126 | 8LG | 0.9414 |
127 | SYN | 0.9409 |
128 | PYZ | 0.9409 |
129 | CYS | 0.9406 |
130 | HGY | 0.9403 |
131 | OXE | 0.9393 |
132 | PRO | 0.9393 |
133 | BVC | 0.9390 |
134 | BEW | 0.9388 |
135 | ABN | 0.9387 |
136 | 92Z | 0.9387 |
137 | 4JN | 0.9386 |
138 | B20 | 0.9382 |
139 | APY | 0.9382 |
140 | PYR | 0.9380 |
141 | 4CH | 0.9377 |
142 | BNZ | 0.9376 |
143 | 2OP | 0.9375 |
144 | 3PY | 0.9369 |
145 | 0PY | 0.9363 |
146 | FP2 | 0.9362 |
147 | AMC | 0.9360 |
148 | JZ0 | 0.9358 |
149 | 93Q | 0.9357 |
150 | FPI | 0.9354 |
151 | MZW | 0.9353 |
152 | J1Z | 0.9349 |
153 | BVG | 0.9344 |
154 | P1R | 0.9339 |
155 | HBX | 0.9337 |
156 | 938 | 0.9336 |
157 | LAC | 0.9334 |
158 | ECE | 0.9328 |
159 | KG7 | 0.9325 |
160 | PHZ | 0.9324 |
161 | 3OH | 0.9320 |
162 | DAL | 0.9320 |
163 | ABA | 0.9319 |
164 | 2AF | 0.9312 |
165 | 6SP | 0.9312 |
166 | SAR | 0.9309 |
167 | ALA | 0.9306 |
168 | HVQ | 0.9305 |
169 | MAK | 0.9299 |
170 | OXD | 0.9299 |
171 | GLV | 0.9298 |
172 | FOA | 0.9296 |
173 | 2HA | 0.9284 |
174 | AKR | 0.9279 |
175 | FW5 | 0.9273 |
176 | IOL | 0.9269 |
177 | 23W | 0.9269 |
178 | PYM | 0.9264 |
179 | 3MC | 0.9260 |
180 | PY7 | 0.9260 |
181 | 2CH | 0.9258 |
182 | PYC | 0.9257 |
183 | 6X8 | 0.9256 |
184 | BP9 | 0.9253 |
185 | HTS | 0.9248 |
186 | 47J | 0.9247 |
187 | MBD | 0.9242 |
188 | PYF | 0.9237 |
189 | DTL | 0.9233 |
190 | ICC | 0.9231 |
191 | PYJ | 0.9230 |
192 | 3FA | 0.9229 |
193 | GOA | 0.9229 |
194 | NBE | 0.9226 |
195 | GXV | 0.9226 |
196 | 2DR | 0.9225 |
197 | FAH | 0.9225 |
198 | GMN | 0.9225 |
199 | PYG | 0.9225 |
200 | FFP | 0.9223 |
201 | WBU | 0.9223 |
202 | VAL | 0.9222 |
203 | 2C9 | 0.9220 |
204 | 278 | 0.9220 |
205 | URF | 0.9220 |
206 | 1AC | 0.9215 |
207 | HAE | 0.9212 |
208 | FLM | 0.9210 |
209 | 1MR | 0.9209 |
210 | 03W | 0.9209 |
211 | 6MH | 0.9207 |
212 | 2MY | 0.9207 |
213 | BAL | 0.9202 |
214 | 2EZ | 0.9200 |
215 | FPY | 0.9195 |
216 | M2H | 0.9192 |
217 | KIV | 0.9190 |
218 | 1MC | 0.9186 |
219 | GLY | 0.9182 |
220 | A1U | 0.9181 |
221 | PYD | 0.9177 |
222 | ICP | 0.9177 |
223 | NHY | 0.9177 |
224 | GVH | 0.9175 |
225 | B24 | 0.9173 |
226 | PUT | 0.9172 |
227 | 2CM | 0.9170 |
228 | NAK | 0.9170 |
229 | TDR | 0.9167 |
230 | 0R1 | 0.9164 |
231 | 3CE | 0.9163 |
232 | AAE | 0.9160 |
233 | A3B | 0.9157 |
234 | 0CT | 0.9156 |
235 | F3V | 0.9155 |
236 | 3MH | 0.9153 |
237 | AHR | 0.9153 |
238 | NK | 0.9149 |
239 | MPI | 0.9147 |
240 | 265 | 0.9145 |
241 | 9X7 | 0.9145 |
242 | PPI | 0.9143 |
243 | BZI | 0.9141 |
244 | 273 | 0.9139 |
245 | BZF | 0.9138 |
246 | 1DU | 0.9138 |
247 | PCA | 0.9136 |
248 | LZ1 | 0.9134 |
249 | IND | 0.9133 |
250 | NMU | 0.9132 |
251 | YAN | 0.9131 |
252 | TFB | 0.9131 |
253 | HY3 | 0.9128 |
254 | 2PC | 0.9127 |
255 | TP5 | 0.9126 |
256 | XYD | 0.9125 |
257 | MGX | 0.9125 |
258 | 5UC | 0.9124 |
259 | NIE | 0.9123 |
260 | DUB | 0.9120 |
261 | TM4 | 0.9116 |
262 | BUO | 0.9114 |
263 | 4JP | 0.9113 |
264 | NIS | 0.9111 |
265 | XYP | 0.9110 |
266 | DEN | 0.9108 |
267 | JBN | 0.9107 |
268 | THR | 0.9106 |
269 | RP7 | 0.9105 |
270 | TZC | 0.9105 |
271 | 6UA | 0.9104 |
272 | BUA | 0.9103 |
273 | 4ZE | 0.9101 |
274 | DBB | 0.9100 |
275 | JZ3 | 0.9100 |
276 | 9CL | 0.9099 |
277 | SMB | 0.9097 |
278 | 4HO | 0.9094 |
279 | QOS | 0.9093 |
280 | TH0 | 0.9091 |
281 | MCT | 0.9090 |
282 | C2A | 0.9089 |
283 | PRI | 0.9084 |
284 | F50 | 0.9082 |
285 | BR9 | 0.9079 |
286 | 1PT | 0.9079 |
287 | CHT | 0.9078 |
288 | 2RA | 0.9076 |
289 | CP | 0.9075 |
290 | MWM | 0.9073 |
291 | D2P | 0.9071 |
292 | 2MP | 0.9070 |
293 | EGD | 0.9070 |
294 | TM7 | 0.9070 |
295 | 2AC | 0.9069 |
296 | LDU | 0.9069 |
297 | TSZ | 0.9067 |
298 | 61G | 0.9065 |
299 | 27Y | 0.9065 |
300 | XBZ | 0.9063 |
301 | 34A | 0.9062 |
302 | C2N | 0.9062 |
303 | YHO | 0.9061 |
304 | PAE | 0.9059 |
305 | WDL | 0.9058 |
306 | OXQ | 0.9058 |
307 | AGU | 0.9057 |
308 | HUI | 0.9057 |
309 | 5MH | 0.9055 |
310 | 275 | 0.9055 |
311 | IHG | 0.9054 |
312 | R8A | 0.9053 |
313 | JZ2 | 0.9050 |
314 | 4JO | 0.9049 |
315 | MLT | 0.9043 |
316 | 4CL | 0.9043 |
317 | DCY | 0.9041 |
318 | XYS | 0.9040 |
319 | 0R0 | 0.9035 |
320 | DE2 | 0.9035 |
321 | 4JJ | 0.9034 |
322 | 192 | 0.9032 |
323 | 5AC | 0.9031 |
324 | 1XX | 0.9030 |
325 | AX2 | 0.9026 |
326 | BUQ | 0.9025 |
327 | 94N | 0.9023 |
328 | 5ZE | 0.9022 |
329 | 2A1 | 0.9021 |
330 | 43M | 0.9018 |
331 | MWJ | 0.9018 |
332 | MAE | 0.9016 |
333 | C21 | 0.9015 |
334 | 3AY | 0.9015 |
335 | MZG | 0.9014 |
336 | 4JL | 0.9012 |
337 | HVB | 0.9011 |
338 | IUR | 0.9011 |
339 | JZ5 | 0.9008 |
340 | IDM | 0.9006 |
341 | ALO | 0.9005 |
342 | HT4 | 0.9003 |
343 | LXC | 0.8987 |
344 | HBA | 0.8985 |
345 | HSE | 0.8985 |
346 | 2YU | 0.8976 |
347 | GAG | 0.8975 |
348 | 2ZX | 0.8972 |
349 | 4VP | 0.8970 |
350 | ETF | 0.8970 |
351 | BMD | 0.8967 |
352 | OAA | 0.8964 |
353 | 9YL | 0.8963 |
354 | 5JC | 0.8959 |
355 | JAB | 0.8956 |
356 | DTU | 0.8956 |
357 | 5Y9 | 0.8955 |
358 | BU4 | 0.8954 |
359 | 13X | 0.8951 |
360 | BEZ | 0.8950 |
361 | 286 | 0.8950 |
362 | HYP | 0.8949 |
363 | BEN | 0.8945 |
364 | LER | 0.8941 |
365 | PZO | 0.8940 |
366 | R3W | 0.8937 |
367 | 39J | 0.8934 |
368 | GBD | 0.8932 |
369 | 5AN | 0.8926 |
370 | BAM | 0.8925 |
371 | TLD | 0.8923 |
372 | ATO | 0.8922 |
373 | NIO | 0.8921 |
374 | 1AB | 0.8920 |
375 | R2B | 0.8912 |
376 | ALQ | 0.8909 |
377 | IVA | 0.8906 |
378 | 14J | 0.8901 |
379 | PXO | 0.8901 |
380 | TRI | 0.8899 |
381 | IMD | 0.8898 |
382 | UY7 | 0.8898 |
383 | DFB | 0.8896 |
384 | 7WG | 0.8895 |
385 | YCP | 0.8891 |
386 | NCM | 0.8890 |
387 | JZ9 | 0.8890 |
388 | JZ1 | 0.8890 |
389 | MRY | 0.8889 |
390 | 60P | 0.8887 |
391 | NBZ | 0.8884 |
392 | Y8I | 0.8883 |
393 | AKB | 0.8881 |
394 | BRP | 0.8880 |
395 | FYU | 0.8876 |
396 | 9TY | 0.8876 |
397 | VGL | 0.8875 |
398 | ERH | 0.8874 |
399 | PZA | 0.8873 |
400 | SSN | 0.8872 |
401 | HUH | 0.8870 |
402 | SMV | 0.8868 |
403 | C2B | 0.8868 |
404 | NCA | 0.8867 |
405 | 6PC | 0.8862 |
406 | NTN | 0.8861 |
407 | SIN | 0.8860 |
408 | 4DX | 0.8858 |
409 | RIB | 0.8858 |
410 | EDG | 0.8856 |
411 | 51F | 0.8856 |
412 | 3HL | 0.8855 |
413 | MTG | 0.8842 |
414 | HSM | 0.8841 |
415 | 1SP | 0.8839 |
416 | FBA | 0.8838 |
417 | SLP | 0.8837 |
418 | TCV | 0.8836 |
419 | CRN | 0.8835 |
420 | BZX | 0.8833 |
421 | FLA | 0.8833 |
422 | 2K4 | 0.8830 |
423 | T2C | 0.8830 |
424 | BAE | 0.8829 |
425 | PHB | 0.8828 |
426 | 1BP | 0.8821 |
427 | AOA | 0.8817 |
428 | NXA | 0.8817 |
429 | DAB | 0.8813 |
430 | ITN | 0.8813 |
431 | 5H1 | 0.8810 |
432 | 4SD | 0.8810 |
433 | HDA | 0.8808 |
434 | IQ0 | 0.8807 |
435 | RIP | 0.8806 |
436 | H8N | 0.8804 |
437 | M58 | 0.8802 |
438 | 5MI | 0.8801 |
439 | LMR | 0.8801 |
440 | HPA | 0.8801 |
441 | 3XX | 0.8800 |
442 | ITU | 0.8799 |
443 | 6AI | 0.8799 |
444 | YTB | 0.8797 |
445 | ASP | 0.8795 |
446 | OXZ | 0.8795 |
447 | TCZ | 0.8793 |
448 | 5MB | 0.8793 |
449 | DPR | 0.8793 |
450 | 69O | 0.8793 |
451 | FUC | 0.8792 |
452 | R1X | 0.8792 |
453 | O7U | 0.8791 |
454 | CIZ | 0.8790 |
455 | IT2 | 0.8789 |
456 | ARB | 0.8788 |
457 | PRS | 0.8787 |
458 | HV2 | 0.8787 |
459 | AZF | 0.8784 |
460 | SGL | 0.8783 |
461 | 3HR | 0.8780 |
462 | HCS | 0.8779 |
463 | ADE | 0.8776 |
464 | QSC | 0.8775 |
465 | 0MK | 0.8774 |
466 | F60 | 0.8773 |
467 | ES9 | 0.8773 |
468 | UNU | 0.8771 |
469 | IFM | 0.8768 |
470 | 14O | 0.8768 |
471 | F81 | 0.8767 |
472 | R8S | 0.8766 |
473 | 23A | 0.8765 |
474 | J3K | 0.8761 |
475 | IMR | 0.8760 |
476 | 7HP | 0.8758 |
477 | AGK | 0.8757 |
478 | BTL | 0.8757 |
479 | 0TR | 0.8756 |
480 | 6HQ | 0.8751 |
481 | HMH | 0.8749 |
482 | FJO | 0.8749 |
483 | HLT | 0.8747 |
484 | 1DQ | 0.8746 |
485 | NEQ | 0.8744 |
486 | 7CZ | 0.8743 |
487 | 4JM | 0.8741 |
488 | 1DW | 0.8741 |
489 | 9A4 | 0.8740 |
490 | P3K | 0.8739 |
491 | ZZT | 0.8739 |
492 | HLR | 0.8733 |
493 | 11S | 0.8731 |
494 | HBS | 0.8730 |
495 | 24B | 0.8729 |
496 | BXA | 0.8729 |
497 | H4N | 0.8726 |
498 | 8GC | 0.8725 |
499 | 270 | 0.8724 |
500 | TF4 | 0.8724 |
501 | XAP | 0.8723 |
502 | 9HX | 0.8720 |
503 | 9EW | 0.8718 |
504 | ETM | 0.8717 |
505 | FK1 | 0.8716 |
506 | ICN | 0.8715 |
507 | SAL | 0.8714 |
508 | TAY | 0.8712 |
509 | JBE | 0.8708 |
510 | PBC | 0.8706 |
511 | F05 | 0.8704 |
512 | H76 | 0.8703 |
513 | HBR | 0.8700 |
514 | FUL | 0.8700 |
515 | CSS | 0.8699 |
516 | PBE | 0.8697 |
517 | HMU | 0.8696 |
518 | ASN | 0.8694 |
519 | 40E | 0.8693 |
520 | 9DA | 0.8692 |
521 | TB6 | 0.8692 |
522 | SS1 | 0.8688 |
523 | BUB | 0.8687 |
524 | 8H8 | 0.8682 |
525 | CP2 | 0.8681 |
526 | 8NY | 0.8680 |
527 | ES4 | 0.8679 |
528 | ARA | 0.8675 |
529 | SS2 | 0.8672 |
530 | 3Z7 | 0.8671 |
531 | NVA | 0.8669 |
532 | GIF | 0.8667 |
533 | 0RW | 0.8667 |
534 | 2MI | 0.8662 |
535 | SVN | 0.8662 |
536 | P92 | 0.8661 |
537 | BE2 | 0.8661 |
538 | 2HE | 0.8659 |
539 | XRG | 0.8657 |
540 | PM6 | 0.8649 |
541 | UGC | 0.8646 |
542 | 4SV | 0.8646 |
543 | AX7 | 0.8645 |
544 | JAE | 0.8644 |
545 | Z6J | 0.8643 |
546 | 4ZC | 0.8639 |
547 | AC0 | 0.8639 |
548 | 3U4 | 0.8638 |
549 | 3HB | 0.8633 |
550 | ZZ3 | 0.8620 |
551 | 10L | 0.8618 |
552 | BTE | 0.8615 |
553 | ES6 | 0.8613 |
554 | FUM | 0.8611 |
555 | DFU | 0.8610 |
556 | FQI | 0.8608 |
557 | 7WA | 0.8605 |
558 | 6M9 | 0.8589 |
559 | TMH | 0.8588 |
560 | 3SK | 0.8585 |
561 | NSP | 0.8582 |
562 | GAB | 0.8571 |
563 | IP0 | 0.8569 |
564 | 1WD | 0.8568 |
565 | ABU | 0.8567 |
566 | 3NT | 0.8567 |
567 | JIF | 0.8567 |
568 | 3AB | 0.8566 |
569 | 150 | 0.8566 |
570 | VNJ | 0.8554 |
571 | SWD | 0.8553 |
572 | FUF | 0.8550 |
573 | DYA | 0.8544 |
574 | PAV | 0.8540 |
575 | 2XX | 0.8530 |
576 | 53C | 0.8518 |
This union binding pocket(no: 1) in the query (biounit: 3cl7.bio1) has 13 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 3cl7.bio1) has 13 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 3) in the query (biounit: 3cl7.bio1) has 13 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 4) in the query (biounit: 3cl7.bio1) has 13 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 5) in the query (biounit: 3cl7.bio2) has 13 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 6) in the query (biounit: 3cl7.bio2) has 13 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 7) in the query (biounit: 3cl7.bio2) has 13 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 8) in the query (biounit: 3cl7.bio2) has 13 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |