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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 266 families. | |||||
1 | 1UO4 | - | PIH | C6 H5 I | c1ccc(cc1).... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 220 families. | |||||
1 | 1UO4 | - | PIH | C6 H5 I | c1ccc(cc1).... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | PIH | 1 | 1 |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | GXE | 1.0000 |
2 | HGW | 1.0000 |
3 | HHN | 1.0000 |
4 | TTO | 0.9997 |
5 | CYH | 0.9983 |
6 | 8CL | 0.9969 |
7 | HAI | 0.9935 |
8 | CXL | 0.9913 |
9 | MBN | 0.9883 |
10 | IPH | 0.9864 |
11 | V1L | 0.9857 |
12 | PYZ | 0.9849 |
13 | LGA | 0.9824 |
14 | WOT | 0.9823 |
15 | 3AP | 0.9804 |
16 | ES3 | 0.9804 |
17 | A2Q | 0.9796 |
18 | BYZ | 0.9796 |
19 | 93B | 0.9790 |
20 | 2AP | 0.9786 |
21 | HVK | 0.9786 |
22 | 4AP | 0.9780 |
23 | 5KX | 0.9776 |
24 | AMC | 0.9774 |
25 | JZ6 | 0.9764 |
26 | HRZ | 0.9758 |
27 | MZY | 0.9757 |
28 | 4MZ | 0.9755 |
29 | MZ0 | 0.9734 |
30 | 2IM | 0.9733 |
31 | 9PO | 0.9728 |
32 | 5MP | 0.9719 |
33 | 2MZ | 0.9716 |
34 | FPI | 0.9714 |
35 | MR3 | 0.9713 |
36 | 3TR | 0.9699 |
37 | 1MZ | 0.9696 |
38 | HOW | 0.9689 |
39 | 2AI | 0.9680 |
40 | 282 | 0.9679 |
41 | NVI | 0.9662 |
42 | ABN | 0.9654 |
43 | SYN | 0.9632 |
44 | 1CB | 0.9630 |
45 | PYF | 0.9626 |
46 | HBX | 0.9625 |
47 | 7EX | 0.9623 |
48 | PY7 | 0.9615 |
49 | NBE | 0.9614 |
50 | 3MT | 0.9614 |
51 | 4HS | 0.9611 |
52 | CYS | 0.9609 |
53 | BML | 0.9601 |
54 | 6X8 | 0.9600 |
55 | MMZ | 0.9597 |
56 | 4CH | 0.9578 |
57 | 1DH | 0.9577 |
58 | HGQ | 0.9576 |
59 | E60 | 0.9575 |
60 | HHQ | 0.9574 |
61 | IOL | 0.9570 |
62 | 4JN | 0.9568 |
63 | B3R | 0.9565 |
64 | HEW | 0.9564 |
65 | AMT | 0.9559 |
66 | HYN | 0.9554 |
67 | 938 | 0.9547 |
68 | L60 | 0.9540 |
69 | 4JU | 0.9538 |
70 | CIG | 0.9537 |
71 | CRS | 0.9537 |
72 | 2CH | 0.9534 |
73 | BAQ | 0.9534 |
74 | GBL | 0.9529 |
75 | M3T | 0.9525 |
76 | XIX | 0.9525 |
77 | HTS | 0.9521 |
78 | 4H2 | 0.9521 |
79 | BVG | 0.9520 |
80 | BEW | 0.9517 |
81 | ATQ | 0.9510 |
82 | HIU | 0.9509 |
83 | 25T | 0.9505 |
84 | KSW | 0.9501 |
85 | 1MR | 0.9500 |
86 | 3CH | 0.9497 |
87 | MB3 | 0.9496 |
88 | 2MH | 0.9492 |
89 | LG4 | 0.9489 |
90 | PCR | 0.9485 |
91 | 4XX | 0.9480 |
92 | DMI | 0.9475 |
93 | HPY | 0.9474 |
94 | RCO | 0.9467 |
95 | 2KT | 0.9467 |
96 | 93Q | 0.9465 |
97 | URA | 0.9464 |
98 | 280 | 0.9462 |
99 | BVF | 0.9462 |
100 | PYJ | 0.9462 |
101 | 284 | 0.9461 |
102 | LG5 | 0.9458 |
103 | PXY | 0.9457 |
104 | 26D | 0.9455 |
105 | 24T | 0.9454 |
106 | 25R | 0.9450 |
107 | LG3 | 0.9450 |
108 | DA1 | 0.9445 |
109 | HVQ | 0.9441 |
110 | TMZ | 0.9438 |
111 | HSL | 0.9438 |
112 | 8GF | 0.9436 |
113 | 9CL | 0.9435 |
114 | HQE | 0.9433 |
115 | APY | 0.9430 |
116 | JZ0 | 0.9427 |
117 | CEJ | 0.9426 |
118 | CYT | 0.9425 |
119 | BNZ | 0.9422 |
120 | DGY | 0.9422 |
121 | 278 | 0.9420 |
122 | PHZ | 0.9415 |
123 | BVC | 0.9414 |
124 | 0PY | 0.9413 |
125 | 1PT | 0.9405 |
126 | 8LG | 0.9402 |
127 | FPN | 0.9395 |
128 | CAQ | 0.9394 |
129 | P1R | 0.9392 |
130 | DUC | 0.9391 |
131 | B24 | 0.9390 |
132 | B20 | 0.9387 |
133 | 285 | 0.9384 |
134 | 4AX | 0.9380 |
135 | PLQ | 0.9378 |
136 | DTI | 0.9366 |
137 | 2EZ | 0.9360 |
138 | TMT | 0.9358 |
139 | DXX | 0.9356 |
140 | 1AN | 0.9355 |
141 | 92Z | 0.9353 |
142 | ECE | 0.9347 |
143 | DSN | 0.9343 |
144 | JZ3 | 0.9330 |
145 | FP2 | 0.9326 |
146 | 3ZS | 0.9326 |
147 | H3M | 0.9321 |
148 | OHG | 0.9301 |
149 | ICC | 0.9298 |
150 | 3PY | 0.9292 |
151 | 27Y | 0.9291 |
152 | 0R0 | 0.9285 |
153 | HSM | 0.9285 |
154 | GOL | 0.9284 |
155 | PYR | 0.9283 |
156 | 9X7 | 0.9283 |
157 | DMG | 0.9282 |
158 | 76X | 0.9282 |
159 | BR9 | 0.9275 |
160 | 6SP | 0.9272 |
161 | YAN | 0.9270 |
162 | 4CL | 0.9269 |
163 | OXM | 0.9268 |
164 | 1DU | 0.9264 |
165 | TM4 | 0.9263 |
166 | L89 | 0.9254 |
167 | OXL | 0.9253 |
168 | VAL | 0.9250 |
169 | 6MH | 0.9241 |
170 | 2AF | 0.9240 |
171 | MZG | 0.9240 |
172 | OXE | 0.9240 |
173 | DCY | 0.9238 |
174 | MWJ | 0.9235 |
175 | R8A | 0.9230 |
176 | NK | 0.9230 |
177 | PRI | 0.9225 |
178 | KG7 | 0.9224 |
179 | MCT | 0.9223 |
180 | SER | 0.9223 |
181 | 4JJ | 0.9218 |
182 | 4HO | 0.9215 |
183 | 3CE | 0.9211 |
184 | JZ2 | 0.9206 |
185 | A1U | 0.9202 |
186 | LAC | 0.9200 |
187 | 3ZQ | 0.9198 |
188 | IDH | 0.9190 |
189 | ABA | 0.9182 |
190 | H8N | 0.9178 |
191 | 5JC | 0.9178 |
192 | QOS | 0.9174 |
193 | 2AC | 0.9169 |
194 | MZW | 0.9168 |
195 | LDU | 0.9168 |
196 | HBA | 0.9166 |
197 | HSE | 0.9166 |
198 | RSF | 0.9164 |
199 | URF | 0.9156 |
200 | DUB | 0.9155 |
201 | 2CM | 0.9153 |
202 | 3MC | 0.9152 |
203 | 2MY | 0.9151 |
204 | 40O | 0.9150 |
205 | MBD | 0.9148 |
206 | XYD | 0.9148 |
207 | DAL | 0.9148 |
208 | A3B | 0.9146 |
209 | DBB | 0.9146 |
210 | MLA | 0.9143 |
211 | J1Z | 0.9140 |
212 | Y8I | 0.9137 |
213 | ICP | 0.9137 |
214 | PYD | 0.9137 |
215 | BP9 | 0.9135 |
216 | 2RA | 0.9134 |
217 | 94N | 0.9130 |
218 | C2B | 0.9129 |
219 | AHR | 0.9128 |
220 | 1MC | 0.9126 |
221 | 286 | 0.9123 |
222 | 4JO | 0.9123 |
223 | 4JM | 0.9122 |
224 | JZ1 | 0.9121 |
225 | PYG | 0.9120 |
226 | XBZ | 0.9116 |
227 | 4JL | 0.9114 |
228 | 275 | 0.9112 |
229 | MLI | 0.9112 |
230 | 2ZX | 0.9111 |
231 | KIV | 0.9111 |
232 | PHB | 0.9109 |
233 | WBU | 0.9105 |
234 | HGY | 0.9103 |
235 | 4ZE | 0.9102 |
236 | MMU | 0.9100 |
237 | 2C9 | 0.9096 |
238 | C2A | 0.9094 |
239 | ALA | 0.9093 |
240 | 3FA | 0.9091 |
241 | 5MH | 0.9087 |
242 | SAR | 0.9086 |
243 | 3MH | 0.9085 |
244 | RSO | 0.9085 |
245 | FPY | 0.9083 |
246 | 4VP | 0.9081 |
247 | MWM | 0.9080 |
248 | 34A | 0.9077 |
249 | FFP | 0.9077 |
250 | TM7 | 0.9076 |
251 | 2DR | 0.9075 |
252 | P2D | 0.9075 |
253 | PYM | 0.9074 |
254 | 2YU | 0.9069 |
255 | OXD | 0.9069 |
256 | 03W | 0.9066 |
257 | HT4 | 0.9066 |
258 | JBN | 0.9062 |
259 | 4DX | 0.9061 |
260 | GMN | 0.9059 |
261 | FLM | 0.9055 |
262 | TDR | 0.9050 |
263 | NAK | 0.9050 |
264 | EGD | 0.9045 |
265 | BAM | 0.9045 |
266 | R2B | 0.9044 |
267 | C5J | 0.9042 |
268 | 2MP | 0.9041 |
269 | 3OH | 0.9040 |
270 | C2N | 0.9037 |
271 | MAK | 0.9037 |
272 | HUI | 0.9036 |
273 | BEZ | 0.9035 |
274 | NEQ | 0.9035 |
275 | TZC | 0.9034 |
276 | TH0 | 0.9034 |
277 | 39J | 0.9032 |
278 | JAB | 0.9026 |
279 | RP7 | 0.9026 |
280 | HCS | 0.9025 |
281 | RIB | 0.9021 |
282 | 9YL | 0.9020 |
283 | DEN | 0.9019 |
284 | AKR | 0.9017 |
285 | MEU | 0.9016 |
286 | IMD | 0.9016 |
287 | 23W | 0.9016 |
288 | 5ZE | 0.9015 |
289 | PZO | 0.9014 |
290 | PBC | 0.9013 |
291 | HUH | 0.9012 |
292 | TRI | 0.9012 |
293 | NIO | 0.9011 |
294 | PZA | 0.9006 |
295 | XYP | 0.9004 |
296 | BEN | 0.9003 |
297 | YHO | 0.9003 |
298 | JZ5 | 0.8999 |
299 | IUR | 0.8997 |
300 | SMV | 0.8995 |
301 | 3AY | 0.8994 |
302 | 5AN | 0.8992 |
303 | FOA | 0.8992 |
304 | FBA | 0.8990 |
305 | AX2 | 0.8990 |
306 | PYC | 0.8990 |
307 | BUO | 0.8987 |
308 | GVH | 0.8987 |
309 | 7CZ | 0.8987 |
310 | GOA | 0.8984 |
311 | 5UC | 0.8982 |
312 | 6PC | 0.8981 |
313 | WDL | 0.8980 |
314 | 43M | 0.8977 |
315 | P3K | 0.8977 |
316 | NCA | 0.8976 |
317 | 4JP | 0.8975 |
318 | 13X | 0.8975 |
319 | ERH | 0.8967 |
320 | M58 | 0.8963 |
321 | DFB | 0.8963 |
322 | PRO | 0.8961 |
323 | IT2 | 0.8959 |
324 | BAL | 0.8957 |
325 | 69O | 0.8955 |
326 | IND | 0.8954 |
327 | GLV | 0.8954 |
328 | YCP | 0.8954 |
329 | 5Y9 | 0.8953 |
330 | LXC | 0.8949 |
331 | BZF | 0.8948 |
332 | AC0 | 0.8947 |
333 | TCZ | 0.8947 |
334 | BZI | 0.8943 |
335 | 2OP | 0.8943 |
336 | 6UA | 0.8943 |
337 | R1X | 0.8942 |
338 | SS2 | 0.8942 |
339 | 23A | 0.8940 |
340 | BNS | 0.8939 |
341 | TLD | 0.8939 |
342 | MPI | 0.8937 |
343 | IDM | 0.8937 |
344 | 0R1 | 0.8936 |
345 | 47J | 0.8935 |
346 | NTN | 0.8935 |
347 | NVA | 0.8933 |
348 | BUA | 0.8932 |
349 | FAN | 0.8931 |
350 | 1XX | 0.8930 |
351 | NBZ | 0.8928 |
352 | EDG | 0.8926 |
353 | M2H | 0.8926 |
354 | LZ1 | 0.8925 |
355 | XYS | 0.8920 |
356 | UNU | 0.8920 |
357 | IMR | 0.8918 |
358 | 0CT | 0.8915 |
359 | SLP | 0.8915 |
360 | PEA | 0.8915 |
361 | OXQ | 0.8914 |
362 | VGL | 0.8913 |
363 | BMD | 0.8910 |
364 | 1AB | 0.8909 |
365 | FW5 | 0.8908 |
366 | 261 | 0.8905 |
367 | QSC | 0.8900 |
368 | 2HA | 0.8895 |
369 | 5AC | 0.8894 |
370 | HAE | 0.8892 |
371 | CXF | 0.8892 |
372 | ALO | 0.8890 |
373 | 1AC | 0.8889 |
374 | TFB | 0.8888 |
375 | 3GR | 0.8886 |
376 | NHY | 0.8875 |
377 | FAH | 0.8874 |
378 | 4XR | 0.8873 |
379 | FJO | 0.8870 |
380 | 7WG | 0.8864 |
381 | THR | 0.8863 |
382 | PEL | 0.8862 |
383 | ITU | 0.8859 |
384 | MLT | 0.8859 |
385 | LER | 0.8856 |
386 | CHT | 0.8854 |
387 | BR8 | 0.8847 |
388 | GLY | 0.8844 |
389 | NMU | 0.8844 |
390 | GAG | 0.8844 |
391 | F81 | 0.8839 |
392 | IFM | 0.8839 |
393 | NCM | 0.8837 |
394 | CEE | 0.8836 |
395 | BAE | 0.8835 |
396 | GBD | 0.8834 |
397 | NIE | 0.8833 |
398 | 35C | 0.8833 |
399 | MTG | 0.8830 |
400 | 265 | 0.8830 |
401 | TP5 | 0.8828 |
402 | PPI | 0.8825 |
403 | 0TR | 0.8821 |
404 | HBS | 0.8820 |
405 | SS1 | 0.8820 |
406 | OXZ | 0.8815 |
407 | MGX | 0.8815 |
408 | JZ7 | 0.8814 |
409 | AGK | 0.8814 |
410 | 2PC | 0.8813 |
411 | AZF | 0.8813 |
412 | MTD | 0.8809 |
413 | DTU | 0.8797 |
414 | KOJ | 0.8797 |
415 | MRY | 0.8796 |
416 | RIP | 0.8791 |
417 | 3XX | 0.8790 |
418 | C21 | 0.8789 |
419 | T6C | 0.8789 |
420 | R3W | 0.8788 |
421 | 7MH | 0.8787 |
422 | FP1 | 0.8787 |
423 | DAB | 0.8785 |
424 | 51F | 0.8785 |
425 | NIS | 0.8780 |
426 | F50 | 0.8776 |
427 | DTL | 0.8774 |
428 | HY3 | 0.8774 |
429 | ETM | 0.8767 |
430 | GIF | 0.8762 |
431 | FUC | 0.8761 |
432 | GXV | 0.8759 |
433 | ZZ3 | 0.8758 |
434 | RUU | 0.8755 |
435 | ETF | 0.8753 |
436 | HMH | 0.8752 |
437 | HY1 | 0.8751 |
438 | CSS | 0.8750 |
439 | 271 | 0.8749 |
440 | AGU | 0.8749 |
441 | P92 | 0.8747 |
442 | JZ9 | 0.8745 |
443 | TBP | 0.8743 |
444 | 0MK | 0.8743 |
445 | HLT | 0.8742 |
446 | AAE | 0.8735 |
447 | 273 | 0.8729 |
448 | PXO | 0.8729 |
449 | 4ZC | 0.8728 |
450 | 3Z7 | 0.8727 |
451 | HVB | 0.8723 |
452 | JIF | 0.8723 |
453 | TF4 | 0.8720 |
454 | FYU | 0.8715 |
455 | S76 | 0.8714 |
456 | BZX | 0.8714 |
457 | 60P | 0.8711 |
458 | 2A7 | 0.8707 |
459 | 32O | 0.8706 |
460 | IP0 | 0.8704 |
461 | 8H8 | 0.8700 |
462 | FUL | 0.8697 |
463 | 24B | 0.8695 |
464 | 2MI | 0.8693 |
465 | H76 | 0.8691 |
466 | ARA | 0.8691 |
467 | 192 | 0.8690 |
468 | BE2 | 0.8681 |
469 | ALQ | 0.8680 |
470 | MSF | 0.8677 |
471 | ATO | 0.8675 |
472 | 61G | 0.8672 |
473 | ABU | 0.8672 |
474 | 270 | 0.8672 |
475 | HPA | 0.8670 |
476 | ES9 | 0.8668 |
477 | 5MI | 0.8666 |
478 | BTE | 0.8664 |
479 | DFU | 0.8660 |
480 | F3V | 0.8659 |
481 | HYP | 0.8657 |
482 | SWD | 0.8656 |
483 | AX7 | 0.8656 |
484 | SGL | 0.8655 |
485 | 260 | 0.8655 |
486 | ARB | 0.8652 |
487 | 9DA | 0.8650 |
488 | BXA | 0.8650 |
489 | TZE | 0.8649 |
490 | ABV | 0.8642 |
491 | 5MB | 0.8640 |
492 | NSP | 0.8636 |
493 | O7U | 0.8636 |
494 | H4N | 0.8633 |
495 | BTL | 0.8633 |
496 | 11S | 0.8628 |
497 | BSX | 0.8626 |
498 | 9HX | 0.8622 |
499 | ADE | 0.8622 |
500 | HX3 | 0.8621 |
501 | LMR | 0.8619 |
502 | SAL | 0.8619 |
503 | 5H1 | 0.8618 |
504 | 7HP | 0.8616 |
505 | HDA | 0.8612 |
506 | FK1 | 0.8612 |
507 | VNJ | 0.8607 |
508 | 717 | 0.8605 |
509 | 2K4 | 0.8603 |
510 | ZZT | 0.8603 |
511 | 1DW | 0.8596 |
512 | IQ0 | 0.8596 |
513 | 3U4 | 0.8594 |
514 | NMJ | 0.8591 |
515 | ES6 | 0.8586 |
516 | JBE | 0.8581 |
517 | 14O | 0.8580 |
518 | 2HE | 0.8579 |
519 | Z6J | 0.8578 |
520 | FUF | 0.8577 |
521 | HV2 | 0.8573 |
522 | DPR | 0.8572 |
523 | BRP | 0.8567 |
524 | 4SV | 0.8562 |
525 | 3SK | 0.8561 |
526 | CP | 0.8559 |
527 | GAB | 0.8534 |
528 | 3AB | 0.8532 |
529 | 6HQ | 0.8523 |
This union binding pocket(no: 1) in the query (biounit: 1uo4.bio1) has 8 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 1uo4.bio1) has 8 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |