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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 271 families. | |||||
1 | 4O24 | - | 2Q0 | C14 H15 N O2 S2 | CC(C)CN1C(.... |
2 | 6ASC | - | BU7 | C14 H15 N O2 S2 | CCCCN1C(=O.... |
3 | 6X1Z | - | UL1 | C12 H11 N O3 S2 | COc1ccc(cc.... |
4 | 4O4K | - | 2PK | C10 H8 N2 O2 S | [H]/N=C1/N.... |
5 | 6X1Y | - | UKV | C11 H9 N O2 S2 | COc1cccc(c.... |
6 | 4O5G | - | 2PV | C10 H9 N3 O S | [H]/N=C1/N.... |
7 | 4O43 | - | 2PW | C14 H15 N O2 S2 | CC[C@@H](C.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 223 families. | |||||
1 | 4O24 | - | 2Q0 | C14 H15 N O2 S2 | CC(C)CN1C(.... |
2 | 6ASC | - | BU7 | C14 H15 N O2 S2 | CCCCN1C(=O.... |
3 | 6X1Z | - | UL1 | C12 H11 N O3 S2 | COc1ccc(cc.... |
4 | 4O4K | - | 2PK | C10 H8 N2 O2 S | [H]/N=C1/N.... |
5 | 6X1Y | - | UKV | C11 H9 N O2 S2 | COc1cccc(c.... |
6 | 4O5G | - | 2PV | C10 H9 N3 O S | [H]/N=C1/N.... |
7 | 4O43 | - | 2PW | C14 H15 N O2 S2 | CC[C@@H](C.... |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | E3X | 0.9683 |
2 | ERZ | 0.9607 |
3 | 4HB | 0.9550 |
4 | K7H | 0.9507 |
5 | GVY | 0.9507 |
6 | JAH | 0.9468 |
7 | 6FB | 0.9464 |
8 | S0D | 0.9422 |
9 | 6SD | 0.9420 |
10 | FZM | 0.9391 |
11 | SWX | 0.9373 |
12 | TID | 0.9371 |
13 | 5VU | 0.9371 |
14 | JCZ | 0.9350 |
15 | QIV | 0.9349 |
16 | 5S9 | 0.9348 |
17 | LR8 | 0.9343 |
18 | 0K7 | 0.9340 |
19 | B1J | 0.9337 |
20 | A5H | 0.9331 |
21 | C82 | 0.9321 |
22 | 1ZC | 0.9318 |
23 | XCG | 0.9314 |
24 | OLU | 0.9313 |
25 | MJW | 0.9313 |
26 | 0FR | 0.9311 |
27 | PRL | 0.9307 |
28 | ENO | 0.9303 |
29 | 4FP | 0.9302 |
30 | KLS | 0.9300 |
31 | JBZ | 0.9293 |
32 | 92G | 0.9293 |
33 | CX6 | 0.9292 |
34 | 833 | 0.9290 |
35 | 6P3 | 0.9281 |
36 | 2P3 | 0.9281 |
37 | 4FC | 0.9279 |
38 | 0UL | 0.9273 |
39 | HNT | 0.9273 |
40 | TMG | 0.9269 |
41 | 795 | 0.9254 |
42 | 2JX | 0.9250 |
43 | X0U | 0.9249 |
44 | L03 | 0.9248 |
45 | 1A5 | 0.9247 |
46 | 2QC | 0.9247 |
47 | SOJ | 0.9246 |
48 | 3VS | 0.9245 |
49 | S98 | 0.9241 |
50 | X48 | 0.9240 |
51 | L2K | 0.9238 |
52 | 2WU | 0.9236 |
53 | Q0K | 0.9236 |
54 | BP7 | 0.9234 |
55 | 5H6 | 0.9228 |
56 | H75 | 0.9227 |
57 | HRM | 0.9226 |
58 | Y3L | 0.9226 |
59 | BGU | 0.9219 |
60 | YZ9 | 0.9218 |
61 | S60 | 0.9217 |
62 | 7FU | 0.9217 |
63 | 4I8 | 0.9212 |
64 | BQ2 | 0.9207 |
65 | LZ5 | 0.9204 |
66 | N0Z | 0.9203 |
67 | ZTW | 0.9191 |
68 | 1FE | 0.9184 |
69 | A7Q | 0.9184 |
70 | 5GV | 0.9183 |
71 | TYR | 0.9180 |
72 | ITE | 0.9180 |
73 | OJD | 0.9179 |
74 | RSV | 0.9177 |
75 | 6H2 | 0.9176 |
76 | EN1 | 0.9173 |
77 | 397 | 0.9172 |
78 | LO1 | 0.9169 |
79 | 0OK | 0.9165 |
80 | 2J1 | 0.9163 |
81 | G14 | 0.9162 |
82 | TOH | 0.9162 |
83 | AJG | 0.9158 |
84 | AJ1 | 0.9155 |
85 | 28A | 0.9155 |
86 | II4 | 0.9153 |
87 | TPM | 0.9153 |
88 | 0OY | 0.9153 |
89 | AN3 | 0.9151 |
90 | H4B | 0.9150 |
91 | WV7 | 0.9148 |
92 | PIQ | 0.9145 |
93 | 27K | 0.9144 |
94 | EES | 0.9143 |
95 | BVS | 0.9143 |
96 | 3VQ | 0.9143 |
97 | ZSP | 0.9142 |
98 | FCD | 0.9142 |
99 | JMG | 0.9140 |
100 | 657 | 0.9137 |
101 | VC3 | 0.9133 |
102 | XYP XYP | 0.9132 |
103 | 0ON | 0.9132 |
104 | NDD | 0.9128 |
105 | 1KN | 0.9127 |
106 | N1E | 0.9126 |
107 | HH6 | 0.9126 |
108 | 1DR | 0.9125 |
109 | P4T | 0.9121 |
110 | ODK | 0.9120 |
111 | 8D6 | 0.9118 |
112 | FHV | 0.9116 |
113 | JGB | 0.9115 |
114 | 11X | 0.9114 |
115 | 363 | 0.9113 |
116 | C4E | 0.9111 |
117 | 1XS | 0.9111 |
118 | HRD | 0.9110 |
119 | GB5 | 0.9110 |
120 | 4CN | 0.9109 |
121 | 68B | 0.9107 |
122 | AX4 | 0.9107 |
123 | ZRK | 0.9105 |
124 | 4FF | 0.9103 |
125 | M78 | 0.9102 |
126 | 5OR | 0.9100 |
127 | 5TT | 0.9098 |
128 | XIF XYP | 0.9096 |
129 | A9B | 0.9093 |
130 | 848 | 0.9093 |
131 | F4K | 0.9092 |
132 | S7S | 0.9090 |
133 | 0SY | 0.9090 |
134 | XYP XIF | 0.9089 |
135 | FQX | 0.9089 |
136 | MUK | 0.9088 |
137 | F18 | 0.9087 |
138 | GZ2 | 0.9087 |
139 | A5Q | 0.9087 |
140 | U13 | 0.9085 |
141 | PPY | 0.9085 |
142 | 47V | 0.9085 |
143 | FMQ | 0.9085 |
144 | 4ZF | 0.9083 |
145 | 3D8 | 0.9078 |
146 | 9FG | 0.9076 |
147 | IS2 | 0.9073 |
148 | HXY | 0.9070 |
149 | 1EB | 0.9070 |
150 | PQS | 0.9070 |
151 | F02 | 0.9069 |
152 | 0NX | 0.9069 |
153 | 80G | 0.9067 |
154 | 8CC | 0.9067 |
155 | 5E5 | 0.9067 |
156 | 0NJ | 0.9064 |
157 | BIO | 0.9064 |
158 | 2D2 | 0.9061 |
159 | SX2 | 0.9060 |
160 | KLE | 0.9059 |
161 | RA7 | 0.9058 |
162 | JF8 | 0.9055 |
163 | M83 | 0.9054 |
164 | MR4 | 0.9052 |
165 | 4V2 | 0.9051 |
166 | ZZA | 0.9051 |
167 | 3IP | 0.9050 |
168 | CHQ | 0.9050 |
169 | HC4 | 0.9049 |
170 | 4AU | 0.9048 |
171 | EUH | 0.9047 |
172 | XI7 | 0.9046 |
173 | 7KE | 0.9046 |
174 | K80 | 0.9045 |
175 | YE6 | 0.9043 |
176 | N9J | 0.9041 |
177 | DBE | 0.9038 |
178 | NK5 | 0.9034 |
179 | P7V | 0.9034 |
180 | XYS XYP | 0.9034 |
181 | 2FX | 0.9030 |
182 | OQC | 0.9029 |
183 | A5E | 0.9025 |
184 | M4N | 0.9023 |
185 | PQM | 0.9022 |
186 | CK2 | 0.9021 |
187 | 5SJ | 0.9017 |
188 | MSR | 0.9017 |
189 | J38 | 0.9015 |
190 | ANC | 0.9015 |
191 | LR2 | 0.9013 |
192 | 7EH | 0.9013 |
193 | 0DF | 0.9012 |
194 | I2E | 0.9012 |
195 | P81 | 0.9012 |
196 | AOY | 0.9010 |
197 | 8V8 | 0.9010 |
198 | LUM | 0.9008 |
199 | 5B2 | 0.9008 |
200 | PUE | 0.9004 |
201 | A7H | 0.9003 |
202 | A51 | 0.9002 |
203 | 5TY | 0.9000 |
204 | 4AB | 0.8998 |
205 | 613 | 0.8995 |
206 | 9JT | 0.8993 |
207 | AVX | 0.8993 |
208 | A6W | 0.8991 |
209 | 3NF | 0.8989 |
210 | 3R4 | 0.8987 |
211 | 6MW | 0.8987 |
212 | 1AJ | 0.8984 |
213 | MR5 | 0.8984 |
214 | 9R5 | 0.8982 |
215 | GO2 | 0.8982 |
216 | 9UL | 0.8982 |
217 | G2V | 0.8982 |
218 | NY4 | 0.8982 |
219 | HBI | 0.8982 |
220 | H2B | 0.8982 |
221 | EAT | 0.8980 |
222 | EQW | 0.8978 |
223 | S7D | 0.8976 |
224 | GB4 | 0.8973 |
225 | 78Y | 0.8970 |
226 | MD6 | 0.8970 |
227 | HX4 | 0.8970 |
228 | CPZ | 0.8970 |
229 | TYE | 0.8968 |
230 | GNW | 0.8967 |
231 | 4BF | 0.8965 |
232 | 4Z1 | 0.8964 |
233 | 6J5 | 0.8962 |
234 | QBP | 0.8961 |
235 | NKI | 0.8957 |
236 | 3QV | 0.8956 |
237 | WA1 | 0.8953 |
238 | FF2 | 0.8952 |
239 | MR6 | 0.8952 |
240 | A05 | 0.8948 |
241 | 3VX | 0.8946 |
242 | 36Y | 0.8945 |
243 | M6H | 0.8943 |
244 | HNL | 0.8941 |
245 | MXD | 0.8941 |
246 | 9CE | 0.8941 |
247 | IDZ | 0.8939 |
248 | 344 | 0.8939 |
249 | 38E | 0.8937 |
250 | NE2 | 0.8936 |
251 | 92O | 0.8936 |
252 | WCU | 0.8934 |
253 | AOT | 0.8932 |
254 | DRG | 0.8932 |
255 | 6C4 | 0.8932 |
256 | 9NB | 0.8932 |
257 | XYP XDN | 0.8931 |
258 | XDN XYP | 0.8931 |
259 | 4FE | 0.8928 |
260 | CH9 | 0.8927 |
261 | ZHA | 0.8926 |
262 | ZYQ | 0.8924 |
263 | OA1 | 0.8921 |
264 | 5ER | 0.8921 |
265 | S1D | 0.8920 |
266 | CC5 | 0.8919 |
267 | FCW | 0.8918 |
268 | JSX | 0.8918 |
269 | FYR | 0.8916 |
270 | 5O6 | 0.8915 |
271 | 1HP | 0.8915 |
272 | 4GU | 0.8914 |
273 | SNU | 0.8910 |
274 | 6QF | 0.8910 |
275 | 2QU | 0.8906 |
276 | 4G2 | 0.8906 |
277 | FDR | 0.8906 |
278 | JA5 | 0.8906 |
279 | DAH | 0.8905 |
280 | 4UM | 0.8904 |
281 | BZQ | 0.8902 |
282 | N91 | 0.8900 |
283 | KP2 | 0.8896 |
284 | X6W | 0.8896 |
285 | XDL XYP | 0.8895 |
286 | NAL | 0.8895 |
287 | LI7 | 0.8894 |
288 | THA | 0.8893 |
289 | LJ3 | 0.8892 |
290 | KMY | 0.8890 |
291 | D9Z | 0.8890 |
292 | BPY | 0.8890 |
293 | 6KT | 0.8889 |
294 | XYS XYS | 0.8888 |
295 | EST | 0.8886 |
296 | 7MW | 0.8884 |
297 | 7O4 | 0.8884 |
298 | KYN | 0.8884 |
299 | RKV | 0.8884 |
300 | VUP | 0.8883 |
301 | 9FH | 0.8883 |
302 | 3F4 | 0.8882 |
303 | L1T | 0.8882 |
304 | C1M | 0.8881 |
305 | RGK | 0.8880 |
306 | PPN | 0.8878 |
307 | D2G | 0.8877 |
308 | 20D | 0.8876 |
309 | SZ5 | 0.8876 |
310 | NFA | 0.8876 |
311 | 4BY | 0.8875 |
312 | 1FL | 0.8875 |
313 | X2M | 0.8872 |
314 | TYC | 0.8872 |
315 | 5AD | 0.8870 |
316 | SYE | 0.8870 |
317 | 272 | 0.8869 |
318 | 2B4 | 0.8868 |
319 | XRS | 0.8867 |
320 | DTY | 0.8867 |
321 | L22 | 0.8866 |
322 | 5F8 | 0.8866 |
323 | PQV | 0.8865 |
324 | BIK | 0.8864 |
325 | NFZ | 0.8864 |
326 | TJM | 0.8863 |
327 | EYV | 0.8862 |
328 | BNL | 0.8862 |
329 | 3ZB | 0.8861 |
330 | DDU | 0.8860 |
331 | 2GQ | 0.8860 |
332 | BZJ | 0.8857 |
333 | HO6 | 0.8856 |
334 | ANF | 0.8856 |
335 | PTB | 0.8854 |
336 | 2K8 | 0.8854 |
337 | DHC | 0.8853 |
338 | PHE | 0.8852 |
339 | 1SF | 0.8849 |
340 | 68A | 0.8849 |
341 | AP6 | 0.8848 |
342 | 49P | 0.8848 |
343 | 4BL | 0.8847 |
344 | UNJ | 0.8847 |
345 | 1A7 | 0.8846 |
346 | 5TU | 0.8845 |
347 | WLH | 0.8845 |
348 | AVA | 0.8842 |
349 | HHS | 0.8842 |
350 | TCR | 0.8841 |
351 | Z21 | 0.8841 |
352 | 1Q1 | 0.8839 |
353 | DFL | 0.8838 |
354 | 5LA | 0.8837 |
355 | YIP | 0.8835 |
356 | 25F | 0.8834 |
357 | HNK | 0.8830 |
358 | 7G2 | 0.8830 |
359 | 50C | 0.8829 |
360 | PHI | 0.8826 |
361 | F40 | 0.8822 |
362 | 3SU | 0.8821 |
363 | 9PL | 0.8821 |
364 | 1Z6 | 0.8820 |
365 | EZL | 0.8820 |
366 | BX4 | 0.8817 |
367 | GJG | 0.8815 |
368 | 26C | 0.8814 |
369 | 4LW | 0.8814 |
370 | A73 | 0.8813 |
371 | GOE | 0.8813 |
372 | BBY | 0.8812 |
373 | ALE | 0.8812 |
374 | 6C5 | 0.8811 |
375 | 0XR | 0.8808 |
376 | EQU | 0.8808 |
377 | S0E | 0.8807 |
378 | PJW | 0.8806 |
379 | AA | 0.8801 |
380 | I3E | 0.8801 |
381 | 1V1 | 0.8800 |
382 | ZEC | 0.8798 |
383 | ZRL | 0.8794 |
384 | 2L1 | 0.8794 |
385 | 56D | 0.8792 |
386 | TCC | 0.8791 |
387 | J6W | 0.8789 |
388 | DXK | 0.8789 |
389 | NPS | 0.8788 |
390 | KTJ | 0.8786 |
391 | 6C8 | 0.8785 |
392 | A63 | 0.8784 |
393 | FBC | 0.8784 |
394 | 1BW | 0.8782 |
395 | TRP | 0.8781 |
396 | EAE | 0.8781 |
397 | 0BP | 0.8780 |
398 | 3VW | 0.8779 |
399 | IWT | 0.8779 |
400 | 5FL | 0.8779 |
401 | D3G | 0.8779 |
402 | 3Y7 | 0.8779 |
403 | UAY | 0.8777 |
404 | PLP | 0.8776 |
405 | 5OO | 0.8771 |
406 | LWA | 0.8770 |
407 | 7G0 | 0.8768 |
408 | TIA | 0.8768 |
409 | 6VW | 0.8766 |
410 | FHC | 0.8766 |
411 | YE7 | 0.8765 |
412 | 492 | 0.8761 |
413 | E1K | 0.8760 |
414 | 6DQ | 0.8760 |
415 | 1VK | 0.8760 |
416 | 1V4 | 0.8758 |
417 | 7VP | 0.8758 |
418 | P4L | 0.8755 |
419 | 9B3 | 0.8754 |
420 | SJK | 0.8753 |
421 | LFN | 0.8753 |
422 | WS7 | 0.8752 |
423 | 1PS | 0.8752 |
424 | ZEA | 0.8750 |
425 | 22L | 0.8750 |
426 | AWE | 0.8750 |
427 | K3D | 0.8750 |
428 | 54E | 0.8748 |
429 | FT2 | 0.8748 |
430 | KWV | 0.8748 |
431 | 9KZ | 0.8747 |
432 | D25 | 0.8746 |
433 | AES | 0.8746 |
434 | J1K | 0.8743 |
435 | 1V3 | 0.8742 |
436 | 5NR | 0.8742 |
437 | NRA | 0.8741 |
438 | 8XL | 0.8741 |
439 | LL1 | 0.8738 |
440 | 4NP | 0.8735 |
441 | PFF | 0.8735 |
442 | F4E | 0.8734 |
443 | 120 | 0.8732 |
444 | CFA | 0.8731 |
445 | 6L6 | 0.8730 |
446 | 9CA | 0.8730 |
447 | DX2 | 0.8730 |
448 | IIH | 0.8729 |
449 | 801 | 0.8727 |
450 | K97 | 0.8724 |
451 | 4NR | 0.8720 |
452 | 6FG | 0.8720 |
453 | HCI | 0.8719 |
454 | 1Q2 | 0.8717 |
455 | NE1 | 0.8716 |
456 | ZYR | 0.8716 |
457 | P1J | 0.8715 |
458 | BMZ | 0.8713 |
459 | CR4 | 0.8713 |
460 | 1HN | 0.8713 |
461 | JFS | 0.8713 |
462 | 5SD | 0.8711 |
463 | ESX | 0.8710 |
464 | IQW | 0.8710 |
465 | 39Z | 0.8710 |
466 | 245 | 0.8709 |
467 | ESJ | 0.8708 |
468 | 1OT | 0.8708 |
469 | CNI | 0.8706 |
470 | 121 | 0.8705 |
471 | 124 | 0.8701 |
472 | 5TO | 0.8699 |
473 | WG8 | 0.8696 |
474 | X11 | 0.8695 |
475 | IOP | 0.8693 |
476 | RDT | 0.8690 |
477 | BVA | 0.8690 |
478 | 27M | 0.8689 |
479 | NIF | 0.8688 |
480 | 3XH | 0.8688 |
481 | LVY | 0.8686 |
482 | 8NB | 0.8686 |
483 | 0LO | 0.8685 |
484 | 6ZE | 0.8681 |
485 | TZF | 0.8681 |
486 | AMR | 0.8680 |
487 | J3Z | 0.8679 |
488 | RYV | 0.8678 |
489 | 5V7 | 0.8678 |
490 | PH2 | 0.8677 |
491 | LEL | 0.8677 |
492 | 4RU | 0.8677 |
493 | 4MB | 0.8676 |
494 | 18E | 0.8675 |
495 | 15E | 0.8674 |
496 | GJP | 0.8673 |
497 | 6ZX | 0.8672 |
498 | 7FZ | 0.8672 |
499 | R9J | 0.8670 |
500 | GEN | 0.8670 |
501 | M5H | 0.8670 |
502 | MPV | 0.8667 |
503 | 61M | 0.8666 |
504 | K4V | 0.8666 |
505 | XIZ | 0.8665 |
506 | 22F | 0.8665 |
507 | SNO | 0.8660 |
508 | VM1 | 0.8659 |
509 | 4CF | 0.8657 |
510 | TCA | 0.8655 |
511 | 1UZ | 0.8655 |
512 | 5TZ | 0.8654 |
513 | GAE | 0.8653 |
514 | BIH | 0.8649 |
515 | EWG | 0.8649 |
516 | 1IT | 0.8647 |
517 | V1T | 0.8646 |
518 | 3J8 | 0.8645 |
519 | 5GT | 0.8642 |
520 | ENW | 0.8642 |
521 | NAG | 0.8639 |
522 | JRO | 0.8637 |
523 | 9FL | 0.8637 |
524 | 54X | 0.8637 |
525 | WSD | 0.8631 |
526 | IQZ | 0.8631 |
527 | P80 | 0.8630 |
528 | Q9T | 0.8625 |
529 | BZE | 0.8622 |
530 | SQM | 0.8613 |
531 | ESP | 0.8612 |
532 | DUR | 0.8610 |
533 | 27F | 0.8610 |
534 | 5VL | 0.8610 |
535 | 08C | 0.8609 |
536 | 27B | 0.8608 |
537 | 2HC | 0.8608 |
538 | JG8 | 0.8608 |
539 | Z3R | 0.8604 |
540 | JF5 | 0.8604 |
541 | 8MO | 0.8604 |
542 | SLS | 0.8603 |
543 | 4NS | 0.8602 |
544 | 1V8 | 0.8601 |
545 | XYP XYS | 0.8601 |
546 | WS6 | 0.8598 |
547 | 1L5 | 0.8597 |
548 | DBS | 0.8594 |
549 | DCZ | 0.8592 |
550 | 549 | 0.8590 |
551 | FER | 0.8588 |
552 | 0JD | 0.8586 |
553 | 92P | 0.8584 |
554 | HHR | 0.8582 |
555 | 7EL | 0.8580 |
556 | 5M2 | 0.8576 |
557 | 135 | 0.8572 |
558 | YZM | 0.8569 |
559 | 9ZE | 0.8565 |
560 | ANB | 0.8565 |
561 | HJ7 | 0.8560 |
562 | TYL | 0.8559 |
563 | 15N | 0.8552 |
564 | 51Y | 0.8551 |
565 | PH3 | 0.8544 |
566 | 4LV | 0.8540 |
567 | CUE | 0.8538 |
568 | 5NN | 0.8538 |
569 | BGN | 0.8533 |
570 | 0FK | 0.8520 |
571 | OA4 | 0.8514 |
572 | NCT | 0.8510 |
This union binding pocket(no: 1) in the query (biounit: 6x1z.bio1) has 53 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
1 | 6RQP | OLC | 3.05677 |
This union binding pocket(no: 2) in the query (biounit: 6x1z.bio1) has 53 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
1 | 6RQP | OLC | 3.05677 |