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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 214 families. | |||||
1 | 2RC9 | - | 1AC | C4 H7 N O2 | C1CC1(C(=O.... |
2 | 2RC8 | - | DSN | C3 H7 N O3 | C([C@H](C(.... |
3 | 2RC7 | - | GLY | C2 H5 N O2 | C(C(=O)O)N |
4 | 2RCB | - | DSN | C3 H7 N O3 | C([C@H](C(.... |
5 | 2RCA | Kd = 16.4 nM | GLY | C2 H5 N O2 | C(C(=O)O)N |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 181 families. | |||||
1 | 3OEM | - | OEM | C5 H9 N O4 | CN[C@H](CC.... |
2 | 3OEN | - | GLU | C5 H9 N O4 | C(CC(=O)O).... |
3 | 3OEK | - | ASP | C4 H7 N O4 | C([C@@H](C.... |
4 | 4JWY | - | 1N4 | C8 H13 N3 O3 | CCCc1cnn(c.... |
5 | 3OEL | - | DGL | C5 H9 N O4 | C(CC(=O)O).... |
6 | 4JWX | - | 1N4 | C8 H13 N3 O3 | CCCc1cnn(c.... |
7 | 2A5S | - | GLU | C5 H9 N O4 | C(CC(=O)O).... |
8 | 2RC9 | - | 1AC | C4 H7 N O2 | C1CC1(C(=O.... |
9 | 2RC8 | - | DSN | C3 H7 N O3 | C([C@H](C(.... |
10 | 2RC7 | - | GLY | C2 H5 N O2 | C(C(=O)O)N |
11 | 2RCB | - | DSN | C3 H7 N O3 | C([C@H](C(.... |
12 | 2RCA | Kd = 16.4 nM | GLY | C2 H5 N O2 | C(C(=O)O)N |
13 | 1Y20 | Ki = 4.8 uM | 1AC | C4 H7 N O2 | C1CC1(C(=O.... |
14 | 1PB7 | - | GLY | C2 H5 N O2 | C(C(=O)O)N |
15 | 1Y1Z | Ki = 0.831 mM | 192 | C5 H9 N O2 | C1CC(C1)(C.... |
16 | 1PB8 | Ki = 7.02 uM | DSN | C3 H7 N O3 | C([C@H](C(.... |
17 | 1Y1M | Ki = 15.3 mM | AC5 | C6 H11 N O2 | C1CCC(C1)(.... |
18 | 1PBQ | Ki = 0.54 uM | DK1 | C10 H5 Cl2 N O3 | c1c(cc(c2c.... |
19 | 1PB9 | Ki = 241 uM | 4AX | C3 H6 N2 O2 | C1[C@H](C(.... |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | DXX | 0.9932 |
2 | OXM | 0.9885 |
3 | SER | 0.9864 |
4 | OXL | 0.9833 |
5 | HUI | 0.9816 |
6 | OXD | 0.9803 |
7 | DSN | 0.9792 |
8 | 2KT | 0.9773 |
9 | PYR | 0.9772 |
10 | LAC | 0.9766 |
11 | NAK | 0.9765 |
12 | TAY | 0.9764 |
13 | DGY | 0.9762 |
14 | 03W | 0.9762 |
15 | PPF | 0.9757 |
16 | 2OP | 0.9753 |
17 | HIU | 0.9748 |
18 | HGY | 0.9740 |
19 | DAL | 0.9737 |
20 | DE2 | 0.9732 |
21 | ALQ | 0.9719 |
22 | ALA | 0.9716 |
23 | BUO | 0.9702 |
24 | NIS | 0.9701 |
25 | 3PY | 0.9670 |
26 | 2RA | 0.9670 |
27 | VAL | 0.9668 |
28 | CYS | 0.9664 |
29 | PYM | 0.9662 |
30 | SMB | 0.9661 |
31 | THR | 0.9656 |
32 | HBR | 0.9650 |
33 | KG7 | 0.9647 |
34 | ALO | 0.9634 |
35 | MLI | 0.9634 |
36 | AKB | 0.9630 |
37 | 39J | 0.9624 |
38 | HBS | 0.9624 |
39 | 5Y9 | 0.9584 |
40 | MLA | 0.9571 |
41 | C2N | 0.9569 |
42 | DCY | 0.9565 |
43 | CHT | 0.9560 |
44 | 3HR | 0.9521 |
45 | 7EX | 0.9511 |
46 | KIV | 0.9507 |
47 | HLT | 0.9502 |
48 | GOL | 0.9501 |
49 | ETF | 0.9495 |
50 | 3OH | 0.9487 |
51 | ABA | 0.9469 |
52 | HSL | 0.9469 |
53 | 8X3 | 0.9465 |
54 | A3B | 0.9462 |
55 | AOA | 0.9462 |
56 | TAU | 0.9458 |
57 | MB3 | 0.9456 |
58 | DBB | 0.9455 |
59 | DTL | 0.9451 |
60 | IPH | 0.9443 |
61 | BAE | 0.9443 |
62 | 23W | 0.9440 |
63 | FJO | 0.9438 |
64 | 2HE | 0.9426 |
65 | POA | 0.9426 |
66 | CYH | 0.9422 |
67 | CXL | 0.9422 |
68 | BU4 | 0.9412 |
69 | PRS | 0.9410 |
70 | TF4 | 0.9401 |
71 | HSE | 0.9400 |
72 | LER | 0.9400 |
73 | HAI | 0.9389 |
74 | 4AX | 0.9386 |
75 | MRY | 0.9386 |
76 | BUQ | 0.9378 |
77 | 280 | 0.9378 |
78 | BAL | 0.9375 |
79 | TFB | 0.9370 |
80 | 3HL | 0.9361 |
81 | 3GR | 0.9359 |
82 | GXV | 0.9355 |
83 | DMG | 0.9355 |
84 | L60 | 0.9353 |
85 | A2Q | 0.9349 |
86 | 2IM | 0.9345 |
87 | 6SP | 0.9342 |
88 | MMZ | 0.9327 |
89 | 40O | 0.9325 |
90 | BAQ | 0.9322 |
91 | NVA | 0.9321 |
92 | IVA | 0.9320 |
93 | 3ZQ | 0.9320 |
94 | 3ZS | 0.9319 |
95 | FW5 | 0.9316 |
96 | 9PO | 0.9315 |
97 | XAP | 0.9314 |
98 | MLM | 0.9308 |
99 | DAB | 0.9308 |
100 | C5J | 0.9307 |
101 | HRZ | 0.9305 |
102 | VX | 0.9299 |
103 | SAR | 0.9294 |
104 | 1CB | 0.9294 |
105 | BUA | 0.9287 |
106 | HV2 | 0.9286 |
107 | HSW | 0.9285 |
108 | VAH | 0.9282 |
109 | DMI | 0.9279 |
110 | PRO | 0.9276 |
111 | GBL | 0.9273 |
112 | P7I | 0.9272 |
113 | LGA | 0.9269 |
114 | THE | 0.9266 |
115 | GOA | 0.9265 |
116 | 9TY | 0.9263 |
117 | 3AP | 0.9261 |
118 | HVK | 0.9255 |
119 | 2AP | 0.9255 |
120 | 4AP | 0.9254 |
121 | KSW | 0.9251 |
122 | HCS | 0.9247 |
123 | DTI | 0.9245 |
124 | ODV | 0.9241 |
125 | 4DX | 0.9240 |
126 | CIZ | 0.9237 |
127 | ATQ | 0.9233 |
128 | AAE | 0.9230 |
129 | FCN | 0.9227 |
130 | MBN | 0.9226 |
131 | MZ0 | 0.9220 |
132 | FAH | 0.9219 |
133 | IQ0 | 0.9218 |
134 | DCD | 0.9215 |
135 | HYN | 0.9215 |
136 | H3M | 0.9215 |
137 | BMD | 0.9214 |
138 | GLY | 0.9213 |
139 | QFH | 0.9212 |
140 | MAE | 0.9212 |
141 | 2HA | 0.9210 |
142 | 93B | 0.9208 |
143 | L89 | 0.9206 |
144 | WOT | 0.9203 |
145 | FLA | 0.9198 |
146 | 1AN | 0.9195 |
147 | 76X | 0.9194 |
148 | AMT | 0.9190 |
149 | NIE | 0.9188 |
150 | SIN | 0.9188 |
151 | BTL | 0.9188 |
152 | FP2 | 0.9187 |
153 | CAQ | 0.9187 |
154 | V1L | 0.9185 |
155 | MAK | 0.9184 |
156 | PAE | 0.9182 |
157 | 4JU | 0.9181 |
158 | 2MH | 0.9181 |
159 | 2AF | 0.9180 |
160 | FMS | 0.9180 |
161 | 9X7 | 0.9175 |
162 | TFS | 0.9174 |
163 | CEJ | 0.9174 |
164 | URA | 0.9174 |
165 | 285 | 0.9170 |
166 | HPY | 0.9170 |
167 | 93Q | 0.9168 |
168 | JZ0 | 0.9166 |
169 | J1Z | 0.9164 |
170 | GLV | 0.9162 |
171 | 8LG | 0.9159 |
172 | ETM | 0.9156 |
173 | ASP | 0.9152 |
174 | 69O | 0.9151 |
175 | P2D | 0.9151 |
176 | 92Z | 0.9151 |
177 | WTZ | 0.9147 |
178 | XIX | 0.9146 |
179 | CNH | 0.9145 |
180 | 2A1 | 0.9145 |
181 | CP | 0.9144 |
182 | OXE | 0.9143 |
183 | DUC | 0.9142 |
184 | TMZ | 0.9142 |
185 | NCM | 0.9142 |
186 | 3MT | 0.9140 |
187 | 4XX | 0.9136 |
188 | DTU | 0.9136 |
189 | ICN | 0.9136 |
190 | 2AI | 0.9135 |
191 | 3TR | 0.9132 |
192 | PPI | 0.9129 |
193 | HOW | 0.9123 |
194 | 938 | 0.9123 |
195 | 278 | 0.9123 |
196 | 3BB | 0.9119 |
197 | J3K | 0.9118 |
198 | SSN | 0.9114 |
199 | HVB | 0.9108 |
200 | TAN | 0.9104 |
201 | BEW | 0.9097 |
202 | COM | 0.9097 |
203 | 23B | 0.9094 |
204 | F3V | 0.9094 |
205 | 1MZ | 0.9093 |
206 | MR3 | 0.9093 |
207 | 2MZ | 0.9092 |
208 | GXE | 0.9090 |
209 | TB0 | 0.9088 |
210 | 2CH | 0.9087 |
211 | 2A3 | 0.9086 |
212 | HTS | 0.9085 |
213 | NVI | 0.9083 |
214 | BVG | 0.9076 |
215 | DPR | 0.9076 |
216 | AKR | 0.9074 |
217 | MZY | 0.9072 |
218 | 2PC | 0.9071 |
219 | 1XX | 0.9069 |
220 | IDH | 0.9068 |
221 | ILE | 0.9067 |
222 | B20 | 0.9065 |
223 | VSO | 0.9065 |
224 | PRI | 0.9063 |
225 | 4MZ | 0.9062 |
226 | R3W | 0.9056 |
227 | HAE | 0.9052 |
228 | GG6 | 0.9049 |
229 | RSF | 0.9049 |
230 | R2B | 0.9048 |
231 | R1X | 0.9048 |
232 | CYT | 0.9043 |
233 | 8CL | 0.9043 |
234 | MPD | 0.9043 |
235 | MEU | 0.9041 |
236 | SAT | 0.9041 |
237 | ECE | 0.9041 |
238 | CRS | 0.9038 |
239 | 284 | 0.9038 |
240 | SYN | 0.9038 |
241 | TMT | 0.9034 |
242 | P1R | 0.9031 |
243 | APY | 0.9030 |
244 | 0PY | 0.9026 |
245 | ASN | 0.9021 |
246 | 24T | 0.9019 |
247 | XPO | 0.9018 |
248 | 273 | 0.9017 |
249 | NHY | 0.9014 |
250 | 8FH | 0.9014 |
251 | CSS | 0.9013 |
252 | TTO | 0.9013 |
253 | F50 | 0.9013 |
254 | BUB | 0.9012 |
255 | DTT | 0.9011 |
256 | BNZ | 0.9008 |
257 | FOA | 0.9006 |
258 | 5MP | 0.9004 |
259 | TLA | 0.9001 |
260 | 2EZ | 0.8999 |
261 | IMR | 0.8999 |
262 | 9SB | 0.8997 |
263 | ITN | 0.8994 |
264 | LG3 | 0.8993 |
265 | AGU | 0.8992 |
266 | MGX | 0.8989 |
267 | PHZ | 0.8988 |
268 | MLT | 0.8986 |
269 | 61G | 0.8984 |
270 | 5KX | 0.8984 |
271 | T2C | 0.8983 |
272 | ICC | 0.8982 |
273 | PYC | 0.8982 |
274 | HY3 | 0.8978 |
275 | HDA | 0.8977 |
276 | PCR | 0.8967 |
277 | HVQ | 0.8967 |
278 | BVC | 0.8967 |
279 | TB6 | 0.8966 |
280 | NEQ | 0.8965 |
281 | HQE | 0.8965 |
282 | LG5 | 0.8963 |
283 | YAN | 0.8963 |
284 | D2P | 0.8961 |
285 | 1AB | 0.8960 |
286 | 6X8 | 0.8960 |
287 | EGD | 0.8958 |
288 | 8GF | 0.8958 |
289 | DA1 | 0.8956 |
290 | JZ6 | 0.8956 |
291 | BXO | 0.8956 |
292 | NMU | 0.8954 |
293 | 1SP | 0.8952 |
294 | 26D | 0.8952 |
295 | HHN | 0.8951 |
296 | HZP | 0.8948 |
297 | 9A4 | 0.8947 |
298 | PLQ | 0.8942 |
299 | URF | 0.8937 |
300 | 25T | 0.8933 |
301 | S0H | 0.8932 |
302 | XYS | 0.8930 |
303 | RCO | 0.8930 |
304 | 3CH | 0.8925 |
305 | 265 | 0.8920 |
306 | 25R | 0.8919 |
307 | EDG | 0.8915 |
308 | SMV | 0.8915 |
309 | TZC | 0.8914 |
310 | FPN | 0.8913 |
311 | 282 | 0.8912 |
312 | 1DQ | 0.8912 |
313 | HGQ | 0.8910 |
314 | XYP | 0.8904 |
315 | BVF | 0.8902 |
316 | UYA | 0.8902 |
317 | RP7 | 0.8902 |
318 | 6HQ | 0.8899 |
319 | TSZ | 0.8897 |
320 | WBU | 0.8896 |
321 | PCT | 0.8893 |
322 | OXQ | 0.8891 |
323 | TDR | 0.8889 |
324 | PIH | 0.8889 |
325 | LG4 | 0.8888 |
326 | AMC | 0.8886 |
327 | MMQ | 0.8880 |
328 | 4JN | 0.8877 |
329 | PCA | 0.8874 |
330 | PAF | 0.8874 |
331 | TP5 | 0.8872 |
332 | 3CL | 0.8871 |
333 | O7U | 0.8869 |
334 | 2DR | 0.8865 |
335 | 4CH | 0.8865 |
336 | PXY | 0.8864 |
337 | PAV | 0.8863 |
338 | FPY | 0.8853 |
339 | R8A | 0.8851 |
340 | B3R | 0.8850 |
341 | HHQ | 0.8850 |
342 | 4HS | 0.8848 |
343 | HEW | 0.8846 |
344 | PXO | 0.8842 |
345 | MMU | 0.8840 |
346 | NBE | 0.8839 |
347 | OAA | 0.8838 |
348 | ICP | 0.8834 |
349 | M3T | 0.8833 |
350 | DAS | 0.8831 |
351 | CIG | 0.8830 |
352 | HGW | 0.8829 |
353 | A1U | 0.8828 |
354 | 1DH | 0.8827 |
355 | 1MC | 0.8827 |
356 | ES3 | 0.8824 |
357 | BYZ | 0.8824 |
358 | MCT | 0.8824 |
359 | ITU | 0.8820 |
360 | JZ1 | 0.8816 |
361 | CP2 | 0.8815 |
362 | LDU | 0.8814 |
363 | ARB | 0.8813 |
364 | 4HO | 0.8812 |
365 | ATO | 0.8811 |
366 | IHG | 0.8807 |
367 | C21 | 0.8807 |
368 | YHO | 0.8805 |
369 | BML | 0.8804 |
370 | IOL | 0.8802 |
371 | NMG | 0.8795 |
372 | 5AC | 0.8794 |
373 | XYD | 0.8792 |
374 | 286 | 0.8792 |
375 | FUB | 0.8790 |
376 | 2AC | 0.8788 |
377 | 7VD | 0.8787 |
378 | PYJ | 0.8778 |
379 | 4H2 | 0.8778 |
380 | MWM | 0.8778 |
381 | 1DU | 0.8773 |
382 | LMR | 0.8771 |
383 | 4ZE | 0.8770 |
384 | AHR | 0.8767 |
385 | BRP | 0.8760 |
386 | 5UC | 0.8758 |
387 | PY7 | 0.8755 |
388 | 3MC | 0.8753 |
389 | ABN | 0.8752 |
390 | TAR | 0.8752 |
391 | 5MH | 0.8751 |
392 | JBN | 0.8750 |
393 | CRN | 0.8748 |
394 | UGC | 0.8748 |
395 | KPL | 0.8747 |
396 | MWJ | 0.8747 |
397 | RUU | 0.8747 |
398 | ARA | 0.8743 |
399 | ALF | 0.8743 |
400 | IUR | 0.8740 |
401 | XLS | 0.8739 |
402 | 9CL | 0.8737 |
403 | GAG | 0.8736 |
404 | 34A | 0.8735 |
405 | SEJ | 0.8734 |
406 | BZI | 0.8733 |
407 | 1MR | 0.8733 |
408 | DEN | 0.8732 |
409 | GVH | 0.8727 |
410 | BXA | 0.8726 |
411 | XBZ | 0.8726 |
412 | FFP | 0.8724 |
413 | PBE | 0.8722 |
414 | 0R1 | 0.8721 |
415 | LZ1 | 0.8720 |
416 | 1PT | 0.8720 |
417 | PYG | 0.8719 |
418 | TH0 | 0.8719 |
419 | BZF | 0.8719 |
420 | 51F | 0.8718 |
421 | 27Y | 0.8712 |
422 | 2YU | 0.8711 |
423 | PYZ | 0.8711 |
424 | MZG | 0.8710 |
425 | 0CT | 0.8708 |
426 | IDM | 0.8704 |
427 | JZ2 | 0.8703 |
428 | 2XX | 0.8702 |
429 | FUM | 0.8700 |
430 | BR9 | 0.8699 |
431 | BDR | 0.8699 |
432 | JAB | 0.8698 |
433 | 98J | 0.8698 |
434 | 4CL | 0.8697 |
435 | B24 | 0.8694 |
436 | ABE | 0.8690 |
437 | 4JJ | 0.8689 |
438 | 4JO | 0.8688 |
439 | 3FA | 0.8687 |
440 | HYP | 0.8686 |
441 | UY7 | 0.8685 |
442 | MBD | 0.8684 |
443 | EFS | 0.8680 |
444 | IND | 0.8676 |
445 | E60 | 0.8676 |
446 | MPI | 0.8675 |
447 | FPI | 0.8674 |
448 | 1BP | 0.8673 |
449 | FLM | 0.8670 |
450 | HT4 | 0.8669 |
451 | DCL | 0.8665 |
452 | RIP | 0.8665 |
453 | 2C9 | 0.8662 |
454 | JZ9 | 0.8660 |
455 | 0MK | 0.8642 |
456 | Z6J | 0.8641 |
457 | NK | 0.8630 |
458 | JZ3 | 0.8630 |
459 | COI | 0.8625 |
460 | 40E | 0.8624 |
461 | 2MY | 0.8611 |
462 | HIO | 0.8609 |
463 | TM7 | 0.8609 |
464 | 2CM | 0.8603 |
465 | HBX | 0.8600 |
466 | PUT | 0.8596 |
467 | TCV | 0.8590 |
468 | 3MH | 0.8571 |
469 | IFM | 0.8568 |
470 | PGA | 0.8557 |
471 | PPV | 0.8553 |
472 | SRT | 0.8549 |
473 | MRZ | 0.8548 |
474 | DUB | 0.8540 |
475 | 0R0 | 0.8510 |
This union binding pocket(no: 1) in the query (biounit: 2rc8.bio1) has 11 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
1 | 4YKI | GLY | 40.2344 |
This union binding pocket(no: 2) in the query (biounit: 2rc8.bio1) has 11 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
1 | 4YKI | GLY | 40.2344 |