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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 277 families. | |||||
1 | 5MZZ | - | 8EW | C6 H8 O4 | CC(=CC(=O).... |
2 | 5MZY | - | 8EZ | C8 H14 O2 | C[C@H]1CCC.... |
3 | 5MZX | - | 4PS | C11 H24 N2 O10 P2 S | CC(C)(CO[P.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 212 families. | |||||
1 | 5MZZ | - | 8EW | C6 H8 O4 | CC(=CC(=O).... |
2 | 5MZY | - | 8EZ | C8 H14 O2 | C[C@H]1CCC.... |
3 | 5MZX | - | 4PS | C11 H24 N2 O10 P2 S | CC(C)(CO[P.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | 8EW | 1 | 1 |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | 6JN | 0.9844 |
2 | GUA | 0.9665 |
3 | 98J | 0.9564 |
4 | NXA | 0.9526 |
5 | MLT | 0.9496 |
6 | KMH | 0.9487 |
7 | AKG | 0.9463 |
8 | 5XB | 0.9457 |
9 | GLU | 0.9440 |
10 | LEU | 0.9439 |
11 | OAA | 0.9424 |
12 | ASP | 0.9412 |
13 | OEG | 0.9404 |
14 | ASN | 0.9399 |
15 | OGA | 0.9374 |
16 | PEP | 0.9367 |
17 | TIU | 0.9367 |
18 | DZA | 0.9346 |
19 | ROR | 0.9341 |
20 | GLN | 0.9332 |
21 | CIZ | 0.9320 |
22 | 3HG | 0.9314 |
23 | TAR | 0.9309 |
24 | URP | 0.9306 |
25 | 3S5 | 0.9301 |
26 | HBU | 0.9298 |
27 | IXW | 0.9281 |
28 | LNO | 0.9273 |
29 | DAS | 0.9263 |
30 | 152 | 0.9258 |
31 | R9S | 0.9255 |
32 | AG2 | 0.9255 |
33 | 0VT | 0.9255 |
34 | TEO | 0.9252 |
35 | 7BC | 0.9246 |
36 | R9M | 0.9246 |
37 | HCI | 0.9246 |
38 | AUD | 0.9245 |
39 | LMR | 0.9233 |
40 | DII | 0.9229 |
41 | AT3 | 0.9228 |
42 | QY9 | 0.9212 |
43 | C5A | 0.9211 |
44 | TLA | 0.9211 |
45 | HIO | 0.9205 |
46 | DGL | 0.9204 |
47 | HZP | 0.9203 |
48 | IOM | 0.9197 |
49 | OKG | 0.9194 |
50 | 2HG | 0.9192 |
51 | A3M | 0.9190 |
52 | FOC | 0.9185 |
53 | CMS | 0.9182 |
54 | SRT | 0.9179 |
55 | MAH | 0.9175 |
56 | GVM | 0.9173 |
57 | 3YP | 0.9169 |
58 | MEV | 0.9166 |
59 | 2AL | 0.9164 |
60 | DGN | 0.9162 |
61 | SOR | 0.9161 |
62 | SIN | 0.9160 |
63 | 41K | 0.9158 |
64 | 9X6 | 0.9157 |
65 | OEM | 0.9156 |
66 | JYD | 0.9154 |
67 | EHM | 0.9150 |
68 | 9SE | 0.9149 |
69 | 2IT | 0.9149 |
70 | 2PG | 0.9140 |
71 | 1CO | 0.9136 |
72 | CRN | 0.9136 |
73 | HCS | 0.9132 |
74 | OOG | 0.9124 |
75 | DHI | 0.9120 |
76 | UGC | 0.9119 |
77 | SPV | 0.9119 |
78 | URQ | 0.9118 |
79 | ORN | 0.9113 |
80 | CCB | 0.9109 |
81 | 9J3 | 0.9108 |
82 | PZI | 0.9108 |
83 | K6V | 0.9107 |
84 | PCA | 0.9104 |
85 | S2G | 0.9101 |
86 | N8P | 0.9100 |
87 | 9ON | 0.9099 |
88 | BE2 | 0.9098 |
89 | SC2 | 0.9096 |
90 | MLE | 0.9096 |
91 | AOS | 0.9094 |
92 | QDK | 0.9089 |
93 | ITN | 0.9088 |
94 | XLS | 0.9081 |
95 | SAL | 0.9081 |
96 | OSE | 0.9075 |
97 | SEP | 0.9075 |
98 | 4LR | 0.9074 |
99 | G3P | 0.9073 |
100 | FK8 | 0.9073 |
101 | URO | 0.9069 |
102 | 6NA | 0.9069 |
103 | FOM | 0.9067 |
104 | PG3 | 0.9066 |
105 | 49F | 0.9065 |
106 | HSE | 0.9064 |
107 | TRA | 0.9062 |
108 | 3PG | 0.9057 |
109 | COI | 0.9056 |
110 | PPR | 0.9055 |
111 | NLE | 0.9054 |
112 | FPK | 0.9053 |
113 | MUC | 0.9052 |
114 | XYL | 0.9050 |
115 | 5HY | 0.9050 |
116 | LPK | 0.9045 |
117 | RAT | 0.9044 |
118 | GGL | 0.9043 |
119 | 2CO | 0.9042 |
120 | GRO | 0.9040 |
121 | N7P | 0.9039 |
122 | LFC | 0.9037 |
123 | DAL DAL | 0.9036 |
124 | 3SL | 0.9031 |
125 | M45 | 0.9030 |
126 | 0V5 | 0.9029 |
127 | 3AB | 0.9027 |
128 | GPF | 0.9022 |
129 | SD4 | 0.9021 |
130 | MAE | 0.9021 |
131 | HTX | 0.9020 |
132 | ICF | 0.9018 |
133 | GLO | 0.9017 |
134 | RUJ | 0.9017 |
135 | AL0 | 0.9017 |
136 | DPF | 0.9017 |
137 | TRC | 0.9017 |
138 | NVA | 0.9016 |
139 | I2M | 0.9011 |
140 | SHV | 0.9010 |
141 | 3OC | 0.9010 |
142 | 2FT | 0.9008 |
143 | XUL | 0.9008 |
144 | 40E | 0.9008 |
145 | IP8 | 0.9004 |
146 | ZGL | 0.9001 |
147 | HIS | 0.8999 |
148 | PHE | 0.8998 |
149 | N6C | 0.8991 |
150 | 9RW | 0.8989 |
151 | HDA | 0.8985 |
152 | AHB | 0.8985 |
153 | 2AS | 0.8985 |
154 | FBV | 0.8983 |
155 | 2DR | 0.8982 |
156 | AHN | 0.8979 |
157 | 7UC | 0.8976 |
158 | MTL | 0.8975 |
159 | PAF | 0.8973 |
160 | PEQ | 0.8972 |
161 | RNS | 0.8972 |
162 | B3M | 0.8966 |
163 | 13P | 0.8964 |
164 | CHH | 0.8964 |
165 | 8EZ | 0.8963 |
166 | ACA | 0.8962 |
167 | GPJ | 0.8960 |
168 | FUM | 0.8959 |
169 | 3U4 | 0.8956 |
170 | GBN | 0.8954 |
171 | ES6 | 0.8954 |
172 | TIH | 0.8952 |
173 | THE | 0.8949 |
174 | GAG | 0.8948 |
175 | DHS | 0.8948 |
176 | PGH | 0.8948 |
177 | DOR | 0.8945 |
178 | SOL | 0.8943 |
179 | S8V | 0.8943 |
180 | MHO | 0.8942 |
181 | SKG | 0.8941 |
182 | 4SD | 0.8940 |
183 | VKC | 0.8939 |
184 | 5FX | 0.8938 |
185 | IP0 | 0.8938 |
186 | 7A8 | 0.8938 |
187 | PAH | 0.8937 |
188 | O7U | 0.8935 |
189 | XBT | 0.8931 |
190 | JKE | 0.8931 |
191 | ONL | 0.8930 |
192 | HPA | 0.8928 |
193 | 9X7 | 0.8927 |
194 | RBL | 0.8926 |
195 | NCD | 0.8926 |
196 | 3SK | 0.8926 |
197 | 24B | 0.8926 |
198 | 173 | 0.8925 |
199 | FYU | 0.8924 |
200 | LUQ | 0.8923 |
201 | P4B | 0.8923 |
202 | GTQ | 0.8922 |
203 | 3BU | 0.8919 |
204 | 9TY | 0.8918 |
205 | TPO | 0.8917 |
206 | GLL | 0.8917 |
207 | MD0 | 0.8916 |
208 | BHH | 0.8916 |
209 | IHG | 0.8914 |
210 | 7WG | 0.8911 |
211 | CS2 | 0.8909 |
212 | ZBT | 0.8909 |
213 | PEZ | 0.8907 |
214 | 54G | 0.8906 |
215 | 5NU | 0.8905 |
216 | MET | 0.8904 |
217 | M44 | 0.8904 |
218 | RIB | 0.8904 |
219 | RB5 | 0.8902 |
220 | PSJ | 0.8898 |
221 | 60P | 0.8897 |
222 | XYP | 0.8897 |
223 | 6M4 | 0.8897 |
224 | HHI | 0.8897 |
225 | LYS | 0.8895 |
226 | TMH | 0.8895 |
227 | ILE | 0.8893 |
228 | SHO | 0.8893 |
229 | 9YT | 0.8892 |
230 | 4MV | 0.8892 |
231 | GLY PRO | 0.8892 |
232 | DYT | 0.8891 |
233 | RSF | 0.8890 |
234 | 3HB | 0.8887 |
235 | ALA ALA | 0.8883 |
236 | PG0 | 0.8881 |
237 | RB0 | 0.8880 |
238 | IFM | 0.8878 |
239 | URA | 0.8877 |
240 | GAB | 0.8876 |
241 | 6LW | 0.8875 |
242 | PPY | 0.8874 |
243 | 650 | 0.8874 |
244 | SKJ | 0.8873 |
245 | VNJ | 0.8872 |
246 | ATH | 0.8871 |
247 | TZL | 0.8871 |
248 | 5RG | 0.8870 |
249 | GAL | 0.8870 |
250 | DAB | 0.8869 |
251 | 1SA | 0.8867 |
252 | SDD | 0.8866 |
253 | HL5 | 0.8866 |
254 | 8GL | 0.8865 |
255 | MSE | 0.8865 |
256 | IT9 | 0.8864 |
257 | UYA | 0.8860 |
258 | SME | 0.8854 |
259 | HYA | 0.8854 |
260 | RNT | 0.8854 |
261 | JZ3 | 0.8852 |
262 | AN0 | 0.8851 |
263 | RMN | 0.8851 |
264 | 2LP | 0.8851 |
265 | TAG | 0.8848 |
266 | 8OZ | 0.8847 |
267 | G2H | 0.8847 |
268 | XSP | 0.8846 |
269 | NMG | 0.8846 |
270 | ONH | 0.8844 |
271 | 4TB | 0.8844 |
272 | NMJ | 0.8843 |
273 | MED | 0.8842 |
274 | 284 | 0.8841 |
275 | TZE | 0.8840 |
276 | 5CU | 0.8839 |
277 | G3H | 0.8838 |
278 | PBE | 0.8836 |
279 | 51R | 0.8835 |
280 | 23W | 0.8833 |
281 | 6CS | 0.8833 |
282 | 2RH | 0.8831 |
283 | GLY CYS | 0.8831 |
284 | KMT | 0.8829 |
285 | 7C3 | 0.8827 |
286 | G4D | 0.8826 |
287 | IPB | 0.8825 |
288 | DOB | 0.8823 |
289 | J0Z | 0.8823 |
290 | DPJ | 0.8823 |
291 | DLY | 0.8821 |
292 | CDV | 0.8818 |
293 | ICT | 0.8817 |
294 | 1AL | 0.8816 |
295 | 53C | 0.8814 |
296 | FUL | 0.8812 |
297 | 3LR | 0.8812 |
298 | LTL | 0.8812 |
299 | SHF | 0.8811 |
300 | 0OC | 0.8810 |
301 | HPY | 0.8810 |
302 | 9TZ | 0.8809 |
303 | NFQ | 0.8809 |
304 | RIP | 0.8807 |
305 | GP9 | 0.8807 |
306 | OXZ | 0.8803 |
307 | 11C | 0.8803 |
308 | DMV | 0.8801 |
309 | RAM | 0.8801 |
310 | CRS | 0.8800 |
311 | SKM | 0.8796 |
312 | F9P | 0.8795 |
313 | 3AL | 0.8794 |
314 | MRZ | 0.8794 |
315 | DIR | 0.8792 |
316 | FEH | 0.8791 |
317 | MAN | 0.8790 |
318 | FLC | 0.8789 |
319 | 4CS | 0.8787 |
320 | DAV | 0.8786 |
321 | HY3 | 0.8784 |
322 | 9GB | 0.8781 |
323 | DTL | 0.8781 |
324 | HYP | 0.8780 |
325 | CIT | 0.8779 |
326 | MRY | 0.8776 |
327 | FA0 | 0.8776 |
328 | CXP | 0.8776 |
329 | JZ4 | 0.8776 |
330 | OHP | 0.8773 |
331 | AHR | 0.8772 |
332 | ACH | 0.8770 |
333 | 1X4 | 0.8770 |
334 | MEQ | 0.8770 |
335 | HFA | 0.8768 |
336 | GCO | 0.8768 |
337 | 1GP | 0.8767 |
338 | XIZ | 0.8766 |
339 | E4P | 0.8766 |
340 | 1LN | 0.8765 |
341 | UN1 | 0.8765 |
342 | 64K | 0.8764 |
343 | KDG | 0.8762 |
344 | 129 | 0.8761 |
345 | 261 | 0.8760 |
346 | 7N0 | 0.8760 |
347 | SF6 | 0.8757 |
348 | SSN | 0.8757 |
349 | 54D | 0.8756 |
350 | CUW | 0.8755 |
351 | HPV | 0.8755 |
352 | Q9Z | 0.8753 |
353 | FSG | 0.8752 |
354 | FUF | 0.8750 |
355 | P22 | 0.8749 |
356 | AC5 | 0.8747 |
357 | ASC | 0.8746 |
358 | 7WV | 0.8743 |
359 | OW4 | 0.8741 |
360 | 5M0 | 0.8740 |
361 | FQI | 0.8740 |
362 | HMS | 0.8740 |
363 | NLP | 0.8739 |
364 | 4SV | 0.8739 |
365 | 5XA | 0.8736 |
366 | SJ5 | 0.8736 |
367 | L3Q | 0.8736 |
368 | 51F | 0.8733 |
369 | GG6 | 0.8733 |
370 | KPL | 0.8732 |
371 | BDF | 0.8731 |
372 | ARB | 0.8727 |
373 | JZ1 | 0.8727 |
374 | 0MK | 0.8727 |
375 | SHI | 0.8725 |
376 | 3PO | 0.8725 |
377 | 8GC | 0.8725 |
378 | GBD | 0.8724 |
379 | KDF | 0.8724 |
380 | BSX | 0.8724 |
381 | DMJ | 0.8724 |
382 | UY7 | 0.8723 |
383 | GZ3 | 0.8712 |
384 | VAH | 0.8711 |
385 | II6 | 0.8709 |
386 | FUD | 0.8709 |
387 | FPY | 0.8708 |
388 | DFB | 0.8707 |
389 | ZZT | 0.8706 |
390 | 269 | 0.8704 |
391 | M6H | 0.8704 |
392 | FUC | 0.8703 |
393 | CNL | 0.8702 |
394 | FUB | 0.8701 |
395 | 3V4 | 0.8701 |
396 | BZX | 0.8701 |
397 | C2A | 0.8696 |
398 | REL | 0.8696 |
399 | 42C | 0.8696 |
400 | K6H | 0.8694 |
401 | KOJ | 0.8694 |
402 | NSP | 0.8690 |
403 | 4M0 | 0.8689 |
404 | 95Z | 0.8687 |
405 | APG | 0.8687 |
406 | M74 | 0.8686 |
407 | XYS | 0.8683 |
408 | AZF | 0.8681 |
409 | ICO | 0.8680 |
410 | 32O | 0.8680 |
411 | DHM | 0.8680 |
412 | BHA | 0.8680 |
413 | HG3 | 0.8675 |
414 | 1P3 | 0.8675 |
415 | 8SZ | 0.8675 |
416 | GLC | 0.8674 |
417 | WTZ | 0.8673 |
418 | 16D | 0.8672 |
419 | 0CG | 0.8671 |
420 | HPN | 0.8668 |
421 | LER | 0.8667 |
422 | 1SP | 0.8665 |
423 | PPK | 0.8663 |
424 | IPM | 0.8654 |
425 | 1AB | 0.8654 |
426 | DZX | 0.8653 |
427 | PO6 | 0.8653 |
428 | N9J | 0.8650 |
429 | GLF | 0.8647 |
430 | LCN | 0.8646 |
431 | 5RN | 0.8645 |
432 | XM0 | 0.8645 |
433 | SF9 | 0.8644 |
434 | FP1 | 0.8643 |
435 | ARA | 0.8642 |
436 | FRU | 0.8642 |
437 | 34V | 0.8641 |
438 | LRH | 0.8640 |
439 | 4HM | 0.8636 |
440 | MPJ | 0.8636 |
441 | ARW | 0.8632 |
442 | DCL | 0.8632 |
443 | H95 | 0.8631 |
444 | HGA | 0.8629 |
445 | AGK | 0.8627 |
446 | YCP | 0.8622 |
447 | LGC | 0.8621 |
448 | RJY | 0.8621 |
449 | IFL | 0.8617 |
450 | GIF | 0.8615 |
451 | B3U | 0.8612 |
452 | HIC | 0.8609 |
453 | XXR | 0.8604 |
454 | QFH | 0.8604 |
455 | RCO | 0.8604 |
456 | DGJ | 0.8602 |
457 | VPR | 0.8601 |
458 | SX1 | 0.8600 |
459 | 47J | 0.8598 |
460 | 5MK | 0.8598 |
461 | FW5 | 0.8597 |
462 | PRY | 0.8597 |
463 | 4RW | 0.8592 |
464 | S2P | 0.8591 |
465 | 0L1 | 0.8589 |
466 | H76 | 0.8586 |
467 | LLH | 0.8583 |
468 | GYE | 0.8576 |
469 | 23B | 0.8576 |
470 | DS0 | 0.8574 |
471 | M2K | 0.8571 |
472 | 3MV | 0.8569 |
473 | Q07 | 0.8565 |
474 | CSS | 0.8563 |
475 | 911 | 0.8563 |
476 | LFR | 0.8559 |
477 | MES | 0.8555 |
478 | WOO | 0.8553 |
479 | ABE | 0.8541 |
480 | M2H | 0.8535 |
481 | F12 | 0.8532 |
482 | 4XR | 0.8526 |
This union binding pocket(no: 1) in the query (biounit: 5mzy.bio1) has 29 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 5mzy.bio1) has 27 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |