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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 426 families. | |||||
1 | 4FQT | - | 0VT | C8 H14 O | CC(=CCCC(=.... |
2 | 5EL2 | - | KBR | C12 H23 N O3 | CC[C@@H](C.... |
3 | 3N7H | Kd = 31.3 uM | DE3 | C12 H17 N O | CCN(CC)C(=.... |
4 | 3OGN | - | 3OG | C18 H32 O4 | CCCCCCCCCC.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 322 families. | |||||
1 | 4FQT | - | 0VT | C8 H14 O | CC(=CCCC(=.... |
2 | 5EL2 | - | KBR | C12 H23 N O3 | CC[C@@H](C.... |
3 | 3N7H | Kd = 31.3 uM | DE3 | C12 H17 N O | CCN(CC)C(=.... |
4 | 3OGN | - | 3OG | C18 H32 O4 | CCCCCCCCCC.... |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | URP | 1.0000 |
2 | GUA | 0.9986 |
3 | OEG | 0.9799 |
4 | AKG | 0.9669 |
5 | 7BC | 0.9641 |
6 | OGA | 0.9634 |
7 | PG3 | 0.9623 |
8 | SIN | 0.9612 |
9 | 9X6 | 0.9583 |
10 | ONL | 0.9550 |
11 | 2HG | 0.9533 |
12 | 3HG | 0.9531 |
13 | LMR | 0.9516 |
14 | 9ON | 0.9516 |
15 | OKG | 0.9506 |
16 | 2IT | 0.9506 |
17 | GLU | 0.9498 |
18 | LEU | 0.9484 |
19 | CCD | 0.9483 |
20 | DGL | 0.9477 |
21 | MAE | 0.9476 |
22 | GGL | 0.9475 |
23 | DAS | 0.9457 |
24 | KMH | 0.9454 |
25 | COI | 0.9450 |
26 | AG2 | 0.9442 |
27 | 4LR | 0.9442 |
28 | S2G | 0.9440 |
29 | IP8 | 0.9435 |
30 | CHH | 0.9434 |
31 | DGN | 0.9431 |
32 | GPJ | 0.9430 |
33 | CCE | 0.9428 |
34 | DAV | 0.9425 |
35 | ACH | 0.9423 |
36 | URO | 0.9423 |
37 | URQ | 0.9422 |
38 | TIU | 0.9419 |
39 | OAA | 0.9405 |
40 | GLN | 0.9394 |
41 | 6NA | 0.9392 |
42 | VKC | 0.9386 |
43 | SHO | 0.9385 |
44 | HTX | 0.9385 |
45 | ZGL | 0.9374 |
46 | RTK | 0.9369 |
47 | MHO | 0.9367 |
48 | 6JN | 0.9351 |
49 | 3S5 | 0.9349 |
50 | 40E | 0.9349 |
51 | H95 | 0.9344 |
52 | NM3 | 0.9338 |
53 | MHN | 0.9332 |
54 | NM2 | 0.9326 |
55 | MUC | 0.9324 |
56 | SHV | 0.9323 |
57 | MLT | 0.9319 |
58 | NLE | 0.9315 |
59 | GPF | 0.9313 |
60 | R9M | 0.9311 |
61 | HE4 | 0.9311 |
62 | 4MV | 0.9306 |
63 | PG0 | 0.9294 |
64 | ORN | 0.9294 |
65 | HX2 | 0.9292 |
66 | ASP | 0.9291 |
67 | KQY | 0.9282 |
68 | HIS | 0.9281 |
69 | GLY GLY | 0.9273 |
70 | 7OD | 0.9272 |
71 | LYS | 0.9271 |
72 | N6C | 0.9269 |
73 | PGA | 0.9266 |
74 | AT3 | 0.9265 |
75 | HPN | 0.9263 |
76 | 16D | 0.9263 |
77 | PAC | 0.9256 |
78 | 8EW | 0.9255 |
79 | ACA | 0.9253 |
80 | LEA | 0.9250 |
81 | TEO | 0.9246 |
82 | 3PG | 0.9242 |
83 | HG3 | 0.9242 |
84 | TIH | 0.9241 |
85 | FUM | 0.9241 |
86 | ASN | 0.9239 |
87 | MET | 0.9231 |
88 | G3H | 0.9228 |
89 | OCT | 0.9218 |
90 | SME | 0.9215 |
91 | QY9 | 0.9209 |
92 | DQY | 0.9208 |
93 | 152 | 0.9206 |
94 | OK7 | 0.9202 |
95 | MAH | 0.9199 |
96 | 9GB | 0.9198 |
97 | 3YP | 0.9191 |
98 | GVM | 0.9191 |
99 | DE5 | 0.9188 |
100 | 49F | 0.9187 |
101 | HCI | 0.9183 |
102 | 5XA | 0.9182 |
103 | 5XB | 0.9181 |
104 | HE2 | 0.9179 |
105 | 9J3 | 0.9177 |
106 | FK8 | 0.9174 |
107 | HPV | 0.9166 |
108 | HHI | 0.9164 |
109 | 3OL | 0.9157 |
110 | J9N | 0.9156 |
111 | ENV | 0.9155 |
112 | SHF | 0.9152 |
113 | BHH | 0.9152 |
114 | NF3 | 0.9150 |
115 | GZ3 | 0.9149 |
116 | 3OM | 0.9147 |
117 | PEP | 0.9140 |
118 | HSO | 0.9134 |
119 | 13P | 0.9134 |
120 | DHI | 0.9132 |
121 | O45 | 0.9128 |
122 | X1S | 0.9128 |
123 | SPA | 0.9128 |
124 | PHB | 0.9127 |
125 | 1KA | 0.9127 |
126 | S8V | 0.9123 |
127 | PGH | 0.9123 |
128 | 3LR | 0.9118 |
129 | PO6 | 0.9114 |
130 | PBZ | 0.9112 |
131 | SD4 | 0.9112 |
132 | SEP | 0.9106 |
133 | K34 | 0.9106 |
134 | M4T | 0.9104 |
135 | UGC | 0.9103 |
136 | PHU | 0.9100 |
137 | RUJ | 0.9097 |
138 | M45 | 0.9090 |
139 | 7C3 | 0.9089 |
140 | 98J | 0.9087 |
141 | IXW | 0.9083 |
142 | OSE | 0.9081 |
143 | DAL DAL | 0.9081 |
144 | PAB | 0.9077 |
145 | SSN | 0.9077 |
146 | UN1 | 0.9077 |
147 | SSB | 0.9076 |
148 | MSE | 0.9076 |
149 | 1GP | 0.9073 |
150 | NPO | 0.9072 |
151 | 4SD | 0.9072 |
152 | YIV | 0.9069 |
153 | 173 | 0.9066 |
154 | BHU | 0.9065 |
155 | M3P | 0.9063 |
156 | 11C | 0.9062 |
157 | PIY | 0.9061 |
158 | 2FT | 0.9060 |
159 | BHL | 0.9060 |
160 | BHL BHL | 0.9060 |
161 | SPV | 0.9059 |
162 | HP6 | 0.9057 |
163 | TCA | 0.9054 |
164 | DHM | 0.9054 |
165 | PC | 0.9052 |
166 | ALA ALA | 0.9052 |
167 | AC6 | 0.9047 |
168 | HSE | 0.9043 |
169 | FOM | 0.9041 |
170 | 2RH | 0.9040 |
171 | DYT | 0.9037 |
172 | PLU | 0.9035 |
173 | G3P | 0.9033 |
174 | 0L1 | 0.9032 |
175 | 1Y6 | 0.9029 |
176 | RB5 | 0.9027 |
177 | MSL | 0.9027 |
178 | DIR | 0.9024 |
179 | NTU | 0.9020 |
180 | JYD | 0.9020 |
181 | 1SH | 0.9016 |
182 | ABU | 0.9014 |
183 | HX4 | 0.9013 |
184 | XYL | 0.9011 |
185 | 8GL | 0.9010 |
186 | GJZ | 0.9010 |
187 | HGA | 0.9009 |
188 | PPY | 0.9007 |
189 | DZA | 0.9006 |
190 | HBD | 0.9005 |
191 | CCU | 0.9004 |
192 | 268 | 0.9003 |
193 | LNO | 0.8997 |
194 | MZT | 0.8995 |
195 | XIZ | 0.8995 |
196 | BNF | 0.8992 |
197 | MEQ | 0.8990 |
198 | HCS | 0.8984 |
199 | K6H | 0.8982 |
200 | M6H | 0.8980 |
201 | PBA | 0.8979 |
202 | NYL | 0.8977 |
203 | DLY | 0.8974 |
204 | AHN | 0.8973 |
205 | ISZ | 0.8971 |
206 | LYN | 0.8970 |
207 | PEQ | 0.8969 |
208 | FBJ | 0.8965 |
209 | 2CO | 0.8964 |
210 | KMT | 0.8960 |
211 | OC9 | 0.8957 |
212 | LTL | 0.8955 |
213 | DYA | 0.8955 |
214 | R2P | 0.8950 |
215 | NFA | 0.8946 |
216 | MED | 0.8944 |
217 | E4P | 0.8941 |
218 | NSB | 0.8941 |
219 | 4WL | 0.8941 |
220 | AL0 | 0.8941 |
221 | PIM | 0.8940 |
222 | GLO | 0.8940 |
223 | 4TB | 0.8939 |
224 | AOT | 0.8939 |
225 | 9YT | 0.8936 |
226 | KDG | 0.8933 |
227 | 266 | 0.8931 |
228 | CYX | 0.8930 |
229 | ZBT | 0.8930 |
230 | 4MA | 0.8929 |
231 | PSE | 0.8929 |
232 | PNZ | 0.8928 |
233 | BUB | 0.8928 |
234 | KTA | 0.8925 |
235 | CFI | 0.8925 |
236 | PHE | 0.8924 |
237 | 0BP | 0.8919 |
238 | 3PP | 0.8918 |
239 | 3SL | 0.8918 |
240 | CXP | 0.8917 |
241 | TZL | 0.8917 |
242 | B40 | 0.8916 |
243 | EOU | 0.8913 |
244 | PRA | 0.8911 |
245 | A5E | 0.8906 |
246 | HL5 | 0.8906 |
247 | 4ZA | 0.8905 |
248 | CXF | 0.8905 |
249 | BHO | 0.8902 |
250 | XBT | 0.8899 |
251 | PPR | 0.8896 |
252 | GP9 | 0.8895 |
253 | NMG | 0.8895 |
254 | 826 | 0.8893 |
255 | MPV | 0.8888 |
256 | TYL | 0.8886 |
257 | HBU | 0.8886 |
258 | RNS | 0.8884 |
259 | F9P | 0.8884 |
260 | AE3 | 0.8879 |
261 | M3H | 0.8877 |
262 | HSM | 0.8876 |
263 | Q9Z | 0.8873 |
264 | F4E | 0.8873 |
265 | HIC | 0.8873 |
266 | K6V | 0.8871 |
267 | N4B | 0.8870 |
268 | DII | 0.8869 |
269 | OOG | 0.8868 |
270 | XRG | 0.8865 |
271 | TPA | 0.8865 |
272 | 4LW | 0.8861 |
273 | B3U | 0.8860 |
274 | I4B | 0.8855 |
275 | 64Z | 0.8855 |
276 | N9J | 0.8855 |
277 | FAN | 0.8854 |
278 | ONH | 0.8848 |
279 | BPN | 0.8848 |
280 | 7A8 | 0.8846 |
281 | DHB | 0.8843 |
282 | 93K | 0.8838 |
283 | IHB | 0.8837 |
284 | AEG | 0.8835 |
285 | FEH | 0.8835 |
286 | 3QM | 0.8830 |
287 | PJL | 0.8829 |
288 | TYE | 0.8828 |
289 | 4P5 | 0.8827 |
290 | BNL | 0.8827 |
291 | 1X4 | 0.8827 |
292 | FOC | 0.8827 |
293 | HDH | 0.8824 |
294 | PMF | 0.8823 |
295 | HMS | 0.8823 |
296 | S2P | 0.8823 |
297 | 011 | 0.8823 |
298 | NIZ | 0.8817 |
299 | 264 | 0.8816 |
300 | AMS | 0.8810 |
301 | B85 | 0.8810 |
302 | MSR | 0.8809 |
303 | 9TW | 0.8808 |
304 | XUL | 0.8807 |
305 | 2FM | 0.8806 |
306 | IWT | 0.8806 |
307 | J0Z | 0.8803 |
308 | SNU | 0.8801 |
309 | 129 | 0.8798 |
310 | INO | 0.8798 |
311 | AMH | 0.8797 |
312 | A8C | 0.8795 |
313 | 258 | 0.8789 |
314 | 7UC | 0.8789 |
315 | LUQ | 0.8787 |
316 | SW7 | 0.8786 |
317 | HY1 | 0.8784 |
318 | OTR | 0.8781 |
319 | 271 | 0.8780 |
320 | PEL | 0.8780 |
321 | HFA | 0.8780 |
322 | A29 | 0.8777 |
323 | ESX | 0.8773 |
324 | 6XA | 0.8770 |
325 | O8Y | 0.8770 |
326 | GLY ALA | 0.8766 |
327 | SHI | 0.8766 |
328 | OCA | 0.8764 |
329 | SKJ | 0.8762 |
330 | PEA | 0.8762 |
331 | P9P | 0.8759 |
332 | TZF | 0.8756 |
333 | FUD | 0.8756 |
334 | QMP | 0.8754 |
335 | I1E | 0.8754 |
336 | NSD | 0.8753 |
337 | CPZ | 0.8751 |
338 | ENW | 0.8746 |
339 | 7VP | 0.8746 |
340 | R67 | 0.8745 |
341 | LT1 | 0.8744 |
342 | 174 | 0.8744 |
343 | SYC | 0.8743 |
344 | TPO | 0.8742 |
345 | ROR | 0.8733 |
346 | HPS | 0.8732 |
347 | ANN | 0.8730 |
348 | MEV | 0.8729 |
349 | P72 | 0.8727 |
350 | LFC | 0.8726 |
351 | RAT | 0.8721 |
352 | HC4 | 0.8715 |
353 | ESP | 0.8712 |
354 | CHB | 0.8707 |
355 | 4NM | 0.8703 |
356 | MPJ | 0.8701 |
357 | DPN | 0.8701 |
358 | NNH | 0.8698 |
359 | 36Y | 0.8698 |
360 | 1F1 | 0.8688 |
361 | 2ZM | 0.8685 |
362 | BZ2 | 0.8684 |
363 | MTL | 0.8684 |
364 | PH3 | 0.8684 |
365 | 6NT | 0.8682 |
366 | FHB | 0.8681 |
367 | HL4 | 0.8681 |
368 | 1L5 | 0.8680 |
369 | YZM | 0.8679 |
370 | M44 | 0.8675 |
371 | CEE | 0.8675 |
372 | ABI | 0.8673 |
373 | A20 | 0.8671 |
374 | 3A9 | 0.8668 |
375 | SOR | 0.8668 |
376 | 5FX | 0.8663 |
377 | 6TZ | 0.8662 |
378 | 5LA | 0.8661 |
379 | R20 | 0.8659 |
380 | P81 | 0.8656 |
381 | 1CO | 0.8651 |
382 | 0HN | 0.8648 |
383 | 4LV | 0.8644 |
384 | 4A3 | 0.8643 |
385 | 2HO | 0.8642 |
386 | JLZ | 0.8641 |
387 | URS | 0.8634 |
388 | 3SS | 0.8632 |
389 | NCT | 0.8626 |
390 | B3M | 0.8619 |
391 | DHR | 0.8618 |
392 | RNT | 0.8618 |
393 | AOS | 0.8616 |
394 | MLZ | 0.8613 |
395 | JB8 | 0.8613 |
396 | 8SZ | 0.8611 |
397 | NLP | 0.8610 |
398 | GLR | 0.8607 |
399 | LQ2 | 0.8602 |
400 | 3NY | 0.8600 |
401 | 54D | 0.8598 |
402 | SN4 | 0.8595 |
403 | MPH | 0.8594 |
404 | JDN | 0.8590 |
405 | JZ7 | 0.8589 |
406 | HQJ | 0.8584 |
407 | NMH | 0.8582 |
408 | P58 | 0.8575 |
409 | L5V | 0.8571 |
410 | JAW | 0.8571 |
411 | HF2 | 0.8561 |
412 | 6NI | 0.8560 |
413 | LNR | 0.8552 |
414 | MES | 0.8551 |
415 | 5NI | 0.8551 |
416 | 9SE | 0.8536 |
417 | I3E | 0.8533 |
This union binding pocket(no: 1) in the query (biounit: 3n7h.bio1) has 49 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 3n7h.bio1) has 50 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |