- Navigate
- Expand All | Collapse All
- Receptor | Ligand | View in 3D
- Family: 90% | 70% | 50% | site
- External Links
- |
- Download
- 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 59 families. | |||||
1 | 3N29 | - | NSD | C6 H17 N3 | C(CN)CNCCC.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 47 families. | |||||
1 | 3N29 | - | NSD | C6 H17 N3 | C(CN)CNCCC.... |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | MMU | 1.0000 |
2 | MEU | 1.0000 |
3 | GXV | 1.0000 |
4 | 2HA | 1.0000 |
5 | 3GR | 0.9972 |
6 | CYS | 0.9965 |
7 | ABA | 0.9919 |
8 | D2P | 0.9818 |
9 | GOA | 0.9811 |
10 | 2KT | 0.9800 |
11 | GLY | 0.9787 |
12 | 3MT | 0.9782 |
13 | F3V | 0.9779 |
14 | HAE | 0.9776 |
15 | GLV | 0.9768 |
16 | 3TR | 0.9764 |
17 | PPI | 0.9761 |
18 | FAH | 0.9754 |
19 | KG7 | 0.9746 |
20 | BAQ | 0.9745 |
21 | 2AI | 0.9744 |
22 | F50 | 0.9741 |
23 | MB3 | 0.9739 |
24 | HYN | 0.9733 |
25 | NHY | 0.9722 |
26 | 1MZ | 0.9719 |
27 | 2MZ | 0.9717 |
28 | XIX | 0.9714 |
29 | 3PY | 0.9712 |
30 | HOW | 0.9712 |
31 | AGU | 0.9708 |
32 | TSZ | 0.9706 |
33 | AKR | 0.9704 |
34 | MR3 | 0.9700 |
35 | 4MZ | 0.9694 |
36 | NMU | 0.9691 |
37 | AMT | 0.9689 |
38 | HVB | 0.9683 |
39 | EGD | 0.9682 |
40 | MGX | 0.9679 |
41 | NIE | 0.9677 |
42 | CEJ | 0.9672 |
43 | OXM | 0.9672 |
44 | CRD | 0.9663 |
45 | 5MP | 0.9659 |
46 | 61G | 0.9658 |
47 | MZY | 0.9658 |
48 | JZ6 | 0.9658 |
49 | GBL | 0.9655 |
50 | 5KX | 0.9650 |
51 | DXX | 0.9649 |
52 | 24T | 0.9638 |
53 | KSW | 0.9637 |
54 | 1CB | 0.9634 |
55 | SAR | 0.9632 |
56 | MMZ | 0.9631 |
57 | OXL | 0.9629 |
58 | 25T | 0.9622 |
59 | NVI | 0.9621 |
60 | SER | 0.9620 |
61 | BRP | 0.9606 |
62 | 3OH | 0.9605 |
63 | ATO | 0.9601 |
64 | XAP | 0.9593 |
65 | DTI | 0.9591 |
66 | HSL | 0.9591 |
67 | PXO | 0.9591 |
68 | PYR | 0.9579 |
69 | DMI | 0.9578 |
70 | 6SP | 0.9577 |
71 | ETF | 0.9576 |
72 | BAL | 0.9576 |
73 | ATQ | 0.9575 |
74 | BYZ | 0.9574 |
75 | BUA | 0.9573 |
76 | E60 | 0.9573 |
77 | A3B | 0.9562 |
78 | 1DH | 0.9555 |
79 | ALA | 0.9551 |
80 | R3W | 0.9551 |
81 | MLA | 0.9546 |
82 | IPH | 0.9543 |
83 | 2A1 | 0.9535 |
84 | AOA | 0.9534 |
85 | 7EX | 0.9532 |
86 | DSN | 0.9529 |
87 | 9A4 | 0.9527 |
88 | DBB | 0.9527 |
89 | 4AX | 0.9526 |
90 | MLM | 0.9521 |
91 | PUT | 0.9521 |
92 | HUI | 0.9520 |
93 | DE2 | 0.9520 |
94 | 9PO | 0.9518 |
95 | DGY | 0.9517 |
96 | ES3 | 0.9516 |
97 | BUQ | 0.9511 |
98 | MLI | 0.9507 |
99 | 9A7 | 0.9505 |
100 | HIU | 0.9502 |
101 | BMD | 0.9502 |
102 | 1AC | 0.9501 |
103 | SMB | 0.9500 |
104 | ETX | 0.9500 |
105 | 3ZS | 0.9500 |
106 | PYZ | 0.9497 |
107 | OXD | 0.9496 |
108 | 4HA | 0.9496 |
109 | TCV | 0.9495 |
110 | 1SP | 0.9491 |
111 | 2AP | 0.9491 |
112 | BVG | 0.9488 |
113 | HVK | 0.9487 |
114 | 2A3 | 0.9484 |
115 | HBS | 0.9481 |
116 | 13D | 0.9481 |
117 | CNH | 0.9480 |
118 | LGA | 0.9479 |
119 | THR | 0.9477 |
120 | BUO | 0.9476 |
121 | BU4 | 0.9474 |
122 | MZ0 | 0.9473 |
123 | NIS | 0.9471 |
124 | ITU | 0.9470 |
125 | 2RA | 0.9469 |
126 | HGY | 0.9467 |
127 | C5J | 0.9466 |
128 | 2OP | 0.9465 |
129 | LAC | 0.9462 |
130 | J3K | 0.9462 |
131 | 3BB | 0.9461 |
132 | 3AP | 0.9457 |
133 | BVC | 0.9454 |
134 | B20 | 0.9454 |
135 | HRZ | 0.9453 |
136 | HVQ | 0.9449 |
137 | MBN | 0.9446 |
138 | CP2 | 0.9446 |
139 | BXO | 0.9445 |
140 | 1BP | 0.9434 |
141 | SLP | 0.9433 |
142 | HBR | 0.9432 |
143 | 39J | 0.9432 |
144 | 4AP | 0.9428 |
145 | 3CL | 0.9428 |
146 | L60 | 0.9422 |
147 | WOT | 0.9416 |
148 | PYM | 0.9415 |
149 | A2Q | 0.9412 |
150 | C2N | 0.9411 |
151 | PRI | 0.9409 |
152 | 93B | 0.9404 |
153 | GXE | 0.9402 |
154 | 2IM | 0.9399 |
155 | 0PY | 0.9393 |
156 | BNZ | 0.9392 |
157 | 2EZ | 0.9389 |
158 | VSO | 0.9378 |
159 | BUB | 0.9377 |
160 | URA | 0.9376 |
161 | NAK | 0.9370 |
162 | HSW | 0.9367 |
163 | ALQ | 0.9357 |
164 | PHZ | 0.9356 |
165 | P1R | 0.9353 |
166 | 8CL | 0.9350 |
167 | DMG | 0.9347 |
168 | CYT | 0.9344 |
169 | V1L | 0.9342 |
170 | OHG | 0.9341 |
171 | LG3 | 0.9341 |
172 | 5Y9 | 0.9338 |
173 | HHN | 0.9336 |
174 | BXA | 0.9334 |
175 | 8GF | 0.9326 |
176 | DAL | 0.9326 |
177 | 26D | 0.9325 |
178 | MTG | 0.9324 |
179 | DCY | 0.9324 |
180 | H3M | 0.9319 |
181 | 9X7 | 0.9316 |
182 | RCO | 0.9313 |
183 | LG5 | 0.9308 |
184 | PE9 | 0.9307 |
185 | CXL | 0.9294 |
186 | CYH | 0.9294 |
187 | TAN | 0.9287 |
188 | 9YL | 0.9284 |
189 | PIH | 0.9284 |
190 | HAI | 0.9282 |
191 | CRS | 0.9282 |
192 | P2D | 0.9281 |
193 | NBN | 0.9280 |
194 | 3CH | 0.9277 |
195 | TTO | 0.9273 |
196 | 285 | 0.9269 |
197 | DUC | 0.9268 |
198 | BVF | 0.9267 |
199 | ABU | 0.9264 |
200 | AML | 0.9257 |
201 | DZZ | 0.9253 |
202 | PZO | 0.9252 |
203 | HGW | 0.9251 |
204 | SSN | 0.9250 |
205 | CIG | 0.9249 |
206 | TRI | 0.9237 |
207 | MSF | 0.9233 |
208 | CHT | 0.9232 |
209 | AAE | 0.9224 |
210 | BBU | 0.9210 |
211 | 192 | 0.9204 |
212 | 92Z | 0.9204 |
213 | HV2 | 0.9200 |
214 | AKB | 0.9199 |
215 | HUH | 0.9199 |
216 | HSE | 0.9199 |
217 | TB0 | 0.9198 |
218 | IMD | 0.9197 |
219 | 4CH | 0.9192 |
220 | DAB | 0.9191 |
221 | 8LG | 0.9187 |
222 | MAK | 0.9187 |
223 | MMQ | 0.9183 |
224 | 03S | 0.9183 |
225 | 280 | 0.9181 |
226 | PY7 | 0.9178 |
227 | TMO | 0.9173 |
228 | KIV | 0.9172 |
229 | ALO | 0.9170 |
230 | 282 | 0.9169 |
231 | HBX | 0.9168 |
232 | NVA | 0.9165 |
233 | TF4 | 0.9165 |
234 | PYF | 0.9164 |
235 | VAL | 0.9163 |
236 | 69O | 0.9158 |
237 | 3HL | 0.9156 |
238 | 4H2 | 0.9153 |
239 | HQE | 0.9152 |
240 | HGQ | 0.9150 |
241 | LEA | 0.9147 |
242 | PXY | 0.9147 |
243 | SYN | 0.9144 |
244 | 1AN | 0.9144 |
245 | BML | 0.9141 |
246 | 23W | 0.9141 |
247 | CAQ | 0.9139 |
248 | 273 | 0.9138 |
249 | HEW | 0.9137 |
250 | 25R | 0.9137 |
251 | M3T | 0.9136 |
252 | HPY | 0.9135 |
253 | RP7 | 0.9134 |
254 | PLQ | 0.9132 |
255 | DA1 | 0.9131 |
256 | LG4 | 0.9129 |
257 | FPN | 0.9128 |
258 | 2HP | 0.9127 |
259 | PCR | 0.9126 |
260 | B3R | 0.9121 |
261 | FP2 | 0.9121 |
262 | 4DX | 0.9121 |
263 | L89 | 0.9120 |
264 | GB | 0.9117 |
265 | 8FH | 0.9115 |
266 | PRS | 0.9114 |
267 | FOA | 0.9112 |
268 | 2PA | 0.9111 |
269 | 3HR | 0.9109 |
270 | POA | 0.9106 |
271 | 93Q | 0.9106 |
272 | MZW | 0.9105 |
273 | BP9 | 0.9105 |
274 | IDH | 0.9104 |
275 | 76X | 0.9104 |
276 | PYC | 0.9102 |
277 | 284 | 0.9101 |
278 | ALF | 0.9100 |
279 | JBN | 0.9096 |
280 | 0CL | 0.9092 |
281 | C21 | 0.9085 |
282 | 2AF | 0.9085 |
283 | TP5 | 0.9084 |
284 | HCS | 0.9083 |
285 | FJO | 0.9080 |
286 | IVA | 0.9078 |
287 | ABN | 0.9073 |
288 | SMV | 0.9070 |
289 | BEW | 0.9070 |
290 | FPO | 0.9069 |
291 | 4JU | 0.9069 |
292 | JZ5 | 0.9069 |
293 | HHQ | 0.9067 |
294 | TAY | 0.9067 |
295 | NOE | 0.9066 |
296 | 1MR | 0.9062 |
297 | OXE | 0.9061 |
298 | NMG | 0.9061 |
299 | 2MH | 0.9057 |
300 | 1DU | 0.9055 |
301 | 3ZQ | 0.9054 |
302 | TAU | 0.9054 |
303 | 8X3 | 0.9053 |
304 | 2HE | 0.9053 |
305 | ACM | 0.9053 |
306 | JZ0 | 0.9053 |
307 | 938 | 0.9053 |
308 | 4JN | 0.9049 |
309 | 2CH | 0.9046 |
310 | EDO | 0.9045 |
311 | PPF | 0.9044 |
312 | J1Z | 0.9042 |
313 | XPO | 0.9041 |
314 | 40O | 0.9040 |
315 | 4HS | 0.9036 |
316 | 2PC | 0.9033 |
317 | 265 | 0.9033 |
318 | DPR | 0.9032 |
319 | NBE | 0.9031 |
320 | ETM | 0.9031 |
321 | 278 | 0.9026 |
322 | HTS | 0.9026 |
323 | ICN | 0.9025 |
324 | LER | 0.9023 |
325 | TZC | 0.9021 |
326 | PRO | 0.9018 |
327 | 4XX | 0.9016 |
328 | IHG | 0.9011 |
329 | 7CL | 0.9010 |
330 | AMC | 0.9010 |
331 | PYJ | 0.9009 |
332 | TBU | 0.9006 |
333 | MAE | 0.9006 |
334 | SEY | 0.9006 |
335 | ACT | 0.9003 |
336 | APY | 0.9001 |
337 | BTL | 0.9001 |
338 | HDA | 0.8999 |
339 | HLT | 0.8998 |
340 | TFB | 0.8993 |
341 | ASP | 0.8991 |
342 | PO4 | 0.8990 |
343 | FPI | 0.8982 |
344 | CP | 0.8976 |
345 | HX2 | 0.8973 |
346 | IOL | 0.8969 |
347 | BAE | 0.8963 |
348 | IPU | 0.8963 |
349 | PAE | 0.8961 |
350 | TMZ | 0.8960 |
351 | BF4 | 0.8960 |
352 | AF3 | 0.8958 |
353 | IQ0 | 0.8951 |
354 | DCD | 0.8942 |
355 | YAN | 0.8941 |
356 | TMT | 0.8940 |
357 | 9CL | 0.8939 |
358 | MTD | 0.8929 |
359 | ISU | 0.8920 |
360 | COM | 0.8915 |
361 | FUM | 0.8911 |
362 | SIN | 0.8911 |
363 | CSS | 0.8903 |
364 | AXO | 0.8903 |
365 | VN4 | 0.8892 |
366 | FUS | 0.8888 |
367 | T2C | 0.8886 |
368 | EFS | 0.8880 |
369 | B24 | 0.8874 |
370 | 6X8 | 0.8871 |
371 | DCE | 0.8867 |
372 | VX | 0.8865 |
373 | NCM | 0.8862 |
374 | HSM | 0.8860 |
375 | OAA | 0.8859 |
376 | BRJ | 0.8858 |
377 | ECE | 0.8845 |
378 | DTT | 0.8834 |
379 | DTU | 0.8834 |
380 | P7I | 0.8833 |
381 | OSM | 0.8832 |
382 | KCS | 0.8830 |
383 | DSS | 0.8826 |
384 | WO6 | 0.8817 |
385 | UGC | 0.8796 |
386 | 9SB | 0.8795 |
387 | ICC | 0.8787 |
388 | TZZ | 0.8785 |
389 | BEF | 0.8785 |
390 | UY7 | 0.8783 |
391 | 9TY | 0.8780 |
392 | ODV | 0.8777 |
393 | 6UA | 0.8775 |
394 | FLA | 0.8768 |
395 | ITN | 0.8760 |
396 | 4SD | 0.8752 |
397 | NXA | 0.8749 |
398 | DCL | 0.8743 |
399 | PZA | 0.8740 |
400 | IPA | 0.8730 |
401 | WTZ | 0.8729 |
402 | QFH | 0.8728 |
403 | ASN | 0.8728 |
404 | LMR | 0.8728 |
405 | AC5 | 0.8721 |
406 | 5AC | 0.8719 |
407 | 2PO | 0.8718 |
408 | JZ3 | 0.8715 |
409 | HY3 | 0.8711 |
410 | HBA | 0.8711 |
411 | 78T | 0.8710 |
412 | BEZ | 0.8709 |
413 | PCA | 0.8707 |
414 | HZP | 0.8699 |
415 | BEN | 0.8698 |
416 | BAM | 0.8687 |
417 | CRN | 0.8686 |
418 | RSF | 0.8686 |
419 | 6PC | 0.8682 |
420 | NCA | 0.8682 |
421 | HYP | 0.8681 |
422 | 2DR | 0.8678 |
423 | NBZ | 0.8673 |
424 | R2B | 0.8672 |
425 | 23B | 0.8670 |
426 | 14J | 0.8666 |
427 | THE | 0.8664 |
428 | 60P | 0.8661 |
429 | UNU | 0.8656 |
430 | NIO | 0.8655 |
431 | NTN | 0.8655 |
432 | 40E | 0.8650 |
433 | MLT | 0.8645 |
434 | COI | 0.8645 |
435 | IOM | 0.8644 |
436 | QPT | 0.8644 |
437 | UYA | 0.8643 |
438 | LDU | 0.8640 |
439 | NK | 0.8629 |
440 | EDG | 0.8623 |
441 | 7WG | 0.8622 |
442 | 4VP | 0.8619 |
443 | GAG | 0.8616 |
444 | LEU | 0.8602 |
445 | R8A | 0.8600 |
446 | CIZ | 0.8593 |
447 | URF | 0.8584 |
448 | 286 | 0.8574 |
449 | 0R0 | 0.8572 |
450 | PBC | 0.8567 |
451 | WBU | 0.8557 |
452 | TB6 | 0.8533 |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | OC9 | 0.9983 |
2 | OYA | 0.9825 |
3 | AE3 | 0.9622 |
4 | OCT | 0.9617 |
5 | PG0 | 0.9514 |
6 | BHL | 0.9509 |
7 | OCA | 0.9502 |
8 | D10 | 0.9471 |
9 | AG2 | 0.9448 |
10 | HE4 | 0.9431 |
11 | 011 | 0.9428 |
12 | 16D | 0.9418 |
13 | 3OM | 0.9388 |
14 | SHV | 0.9377 |
15 | HPL | 0.9343 |
16 | HPN | 0.9340 |
17 | KQY | 0.9338 |
18 | 6XA | 0.9336 |
19 | NWH | 0.9310 |
20 | NF3 | 0.9309 |
21 | ODI | 0.9301 |
22 | BHL BHL | 0.9300 |
23 | MLZ | 0.9295 |
24 | 3OL | 0.9288 |
25 | SSB | 0.9281 |
26 | TEG | 0.9280 |
27 | N6C | 0.9274 |
28 | NTU | 0.9270 |
29 | ACA | 0.9266 |
30 | GVA | 0.9251 |
31 | MHN | 0.9243 |
32 | LYS | 0.9233 |
33 | ONH | 0.9216 |
34 | 5XA | 0.9207 |
35 | 650 | 0.9173 |
36 | AJ3 | 0.9170 |
37 | EOU | 0.9165 |
38 | AKG | 0.9156 |
39 | HP6 | 0.9121 |
40 | 8SZ | 0.9101 |
41 | NMH | 0.9096 |
42 | BHH | 0.9096 |
43 | HE2 | 0.9092 |
44 | 7BC | 0.9086 |
45 | ARG | 0.9084 |
46 | 0L1 | 0.9080 |
47 | ORN | 0.9080 |
48 | ENV | 0.9080 |
49 | GLY GLY | 0.9065 |
50 | PML | 0.9059 |
51 | OGA | 0.9051 |
52 | M1T | 0.9050 |
53 | 7XA | 0.9043 |
54 | ENW | 0.9042 |
55 | K6V | 0.9040 |
56 | MET | 0.9031 |
57 | 4DI | 0.9017 |
58 | KNA | 0.9005 |
59 | GLU | 0.9003 |
60 | UN1 | 0.8998 |
61 | 1H1 | 0.8992 |
62 | PJL | 0.8991 |
63 | 7UC | 0.8979 |
64 | GLN | 0.8970 |
65 | 49F | 0.8967 |
66 | NLE | 0.8964 |
67 | 7C3 | 0.8955 |
68 | 64Z | 0.8954 |
69 | DIA | 0.8953 |
70 | O8Y | 0.8952 |
71 | 6NA | 0.8952 |
72 | GRQ | 0.8939 |
73 | KMH | 0.8939 |
74 | LYN | 0.8936 |
75 | DLY | 0.8919 |
76 | HNE | 0.8915 |
77 | OHJ | 0.8913 |
78 | DKA | 0.8897 |
79 | YIV | 0.8889 |
80 | DHM | 0.8885 |
81 | B3M | 0.8881 |
82 | 8AC | 0.8880 |
83 | G3H | 0.8873 |
84 | X1R | 0.8867 |
85 | G3P | 0.8866 |
86 | DAV | 0.8851 |
87 | 4SD | 0.8846 |
88 | DLT | 0.8843 |
89 | 13P | 0.8843 |
90 | IXW | 0.8842 |
91 | HTX | 0.8841 |
92 | FXY | 0.8840 |
93 | OOG | 0.8839 |
94 | CIR | 0.8838 |
95 | GGB | 0.8837 |
96 | 3HG | 0.8827 |
97 | 266 | 0.8824 |
98 | JX7 | 0.8817 |
99 | PGH | 0.8813 |
100 | RJY | 0.8799 |
101 | N8C | 0.8794 |
102 | FOM | 0.8788 |
103 | AHN | 0.8782 |
104 | MEQ | 0.8778 |
105 | 4TB | 0.8775 |
106 | 11C | 0.8774 |
107 | SME | 0.8772 |
108 | LUQ | 0.8769 |
109 | 9GB | 0.8767 |
110 | CLT | 0.8766 |
111 | HGA | 0.8765 |
112 | 1GP | 0.8762 |
113 | AL0 | 0.8757 |
114 | CUW | 0.8754 |
115 | 0VT | 0.8753 |
116 | VKC | 0.8753 |
117 | 2FM | 0.8744 |
118 | S8V | 0.8742 |
119 | 1KA | 0.8740 |
120 | DZA | 0.8740 |
121 | ONL | 0.8738 |
122 | S2G | 0.8733 |
123 | XRG | 0.8725 |
124 | GLO | 0.8722 |
125 | SHO | 0.8716 |
126 | PKU | 0.8703 |
127 | 3YP | 0.8700 |
128 | LTL | 0.8686 |
129 | KPC | 0.8685 |
130 | XLS | 0.8680 |
131 | 9YT | 0.8672 |
132 | PRO GLY | 0.8662 |
133 | SOR | 0.8650 |
134 | GP9 | 0.8646 |
135 | JFJ | 0.8645 |
136 | 2IT | 0.8638 |
137 | ILO | 0.8638 |
138 | OKG | 0.8635 |
139 | MEV | 0.8619 |
140 | I38 | 0.8612 |
141 | 7OD | 0.8609 |
142 | 2CO | 0.8608 |
143 | 9ON | 0.8608 |
144 | CYX | 0.8598 |
145 | 58X | 0.8593 |
146 | 45L | 0.8581 |
147 | XYL | 0.8575 |
148 | HL5 | 0.8556 |
149 | SD4 | 0.8526 |
This union binding pocket(no: 1) in the query (biounit: 3n29.bio1) has 8 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 3n29.bio1) has 10 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 3) in the query (biounit: 3n29.bio1) has 8 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |