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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 2 families. | |||||
1 | 3BK9 | - | TRP | C11 H12 N2 O2 | c1ccc2c(c1.... |
2 | 2NW9 | - | FT6 | C11 H11 F N2 O2 | c1cc2c(cc1.... |
3 | 3E08 | - | TRP | C11 H12 N2 O2 | c1ccc2c(c1.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 2 families. | |||||
1 | 3BK9 | - | TRP | C11 H12 N2 O2 | c1ccc2c(c1.... |
2 | 2NW9 | - | FT6 | C11 H11 F N2 O2 | c1cc2c(cc1.... |
3 | 3E08 | - | TRP | C11 H12 N2 O2 | c1ccc2c(c1.... |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | 96Z | 0.9695 |
2 | 3IL | 0.9592 |
3 | RSV | 0.9490 |
4 | AZY | 0.9455 |
5 | H4B | 0.9452 |
6 | FCW | 0.9447 |
7 | IOP | 0.9439 |
8 | NIY | 0.9414 |
9 | 4OG | 0.9414 |
10 | NAL | 0.9394 |
11 | 0DF | 0.9368 |
12 | BIO | 0.9356 |
13 | FPL | 0.9356 |
14 | WV7 | 0.9344 |
15 | D1Y | 0.9343 |
16 | BHS | 0.9325 |
17 | 9BF | 0.9324 |
18 | AVA | 0.9320 |
19 | TR7 | 0.9320 |
20 | 2UD | 0.9318 |
21 | 2GQ | 0.9310 |
22 | F40 | 0.9307 |
23 | MJ5 | 0.9307 |
24 | EXL | 0.9302 |
25 | HBI | 0.9297 |
26 | 4AB | 0.9284 |
27 | ZIQ | 0.9280 |
28 | B41 | 0.9278 |
29 | 7EH | 0.9277 |
30 | EXG | 0.9271 |
31 | 0GA | 0.9270 |
32 | ITW | 0.9258 |
33 | 2P3 | 0.9256 |
34 | 7AP | 0.9251 |
35 | H2B | 0.9249 |
36 | 9F8 | 0.9248 |
37 | EV2 | 0.9242 |
38 | KP2 | 0.9241 |
39 | LIG | 0.9226 |
40 | I2E | 0.9226 |
41 | EUH | 0.9220 |
42 | 54E | 0.9219 |
43 | 8RK | 0.9215 |
44 | AWE | 0.9214 |
45 | EV3 | 0.9209 |
46 | 7L4 | 0.9209 |
47 | 3SU | 0.9208 |
48 | PLP | 0.9206 |
49 | 0UL | 0.9198 |
50 | 0OK | 0.9193 |
51 | EUE | 0.9191 |
52 | NPS | 0.9186 |
53 | KWB | 0.9181 |
54 | HH6 | 0.9174 |
55 | 8YH | 0.9170 |
56 | G14 | 0.9168 |
57 | SZ5 | 0.9167 |
58 | A6W | 0.9166 |
59 | PMP | 0.9166 |
60 | ALN | 0.9165 |
61 | JHY | 0.9164 |
62 | C4E | 0.9162 |
63 | SYE | 0.9159 |
64 | EYY | 0.9159 |
65 | 5WN | 0.9158 |
66 | IQW | 0.9158 |
67 | RGK | 0.9156 |
68 | 3EB | 0.9156 |
69 | CX4 | 0.9152 |
70 | 1V4 | 0.9151 |
71 | 2JX | 0.9151 |
72 | 4NR | 0.9150 |
73 | YZ9 | 0.9149 |
74 | 5ER | 0.9148 |
75 | B5A | 0.9146 |
76 | 4CN | 0.9142 |
77 | ASE | 0.9136 |
78 | 833 | 0.9133 |
79 | DX2 | 0.9132 |
80 | 3VW | 0.9132 |
81 | 4I8 | 0.9129 |
82 | 6DQ | 0.9128 |
83 | 657 | 0.9126 |
84 | 1V3 | 0.9118 |
85 | RVE | 0.9118 |
86 | 6QT | 0.9114 |
87 | XEN | 0.9109 |
88 | 108 | 0.9102 |
89 | 1HP | 0.9102 |
90 | IOS | 0.9098 |
91 | D25 | 0.9098 |
92 | AJ1 | 0.9096 |
93 | CC5 | 0.9094 |
94 | NWD | 0.9092 |
95 | PIQ | 0.9091 |
96 | XI7 | 0.9091 |
97 | ZSP | 0.9090 |
98 | 363 | 0.9088 |
99 | 1Q4 | 0.9087 |
100 | II4 | 0.9086 |
101 | WCU | 0.9086 |
102 | 5AD | 0.9084 |
103 | 3F4 | 0.9081 |
104 | X0T | 0.9079 |
105 | 78U | 0.9077 |
106 | T1N | 0.9077 |
107 | TSR | 0.9076 |
108 | KW7 | 0.9072 |
109 | CUH | 0.9068 |
110 | 3D8 | 0.9066 |
111 | AVX | 0.9062 |
112 | NPX | 0.9062 |
113 | 9CE | 0.9060 |
114 | H7S | 0.9058 |
115 | L5D | 0.9057 |
116 | 11X | 0.9057 |
117 | DBE | 0.9054 |
118 | GB4 | 0.9053 |
119 | NIF | 0.9053 |
120 | 109 | 0.9053 |
121 | JCZ | 0.9050 |
122 | 9FH | 0.9050 |
123 | 4BX | 0.9050 |
124 | BVS | 0.9048 |
125 | 6C8 | 0.9048 |
126 | 5TO | 0.9043 |
127 | AP6 | 0.9039 |
128 | JVD | 0.9037 |
129 | E9P | 0.9037 |
130 | 9UL | 0.9036 |
131 | S1D | 0.9035 |
132 | DFL | 0.9034 |
133 | NK5 | 0.9029 |
134 | 25F | 0.9028 |
135 | PW1 | 0.9025 |
136 | 3IB | 0.9024 |
137 | YE6 | 0.9022 |
138 | 8OB | 0.9021 |
139 | QME | 0.9019 |
140 | ENG | 0.9019 |
141 | JSX | 0.9018 |
142 | 0FR | 0.9018 |
143 | Q4G | 0.9018 |
144 | JYW | 0.9018 |
145 | YE7 | 0.9017 |
146 | D64 | 0.9014 |
147 | EI1 | 0.9013 |
148 | MPU | 0.9011 |
149 | IQ5 | 0.9011 |
150 | C0W | 0.9008 |
151 | 68B | 0.9007 |
152 | LP8 | 0.9006 |
153 | GJG | 0.9005 |
154 | DXK | 0.8998 |
155 | YOF | 0.8998 |
156 | X48 | 0.8998 |
157 | M5H | 0.8991 |
158 | 3DE | 0.8989 |
159 | ADN | 0.8988 |
160 | HMZ | 0.8987 |
161 | 52F | 0.8986 |
162 | 27K | 0.8986 |
163 | 3AK | 0.8984 |
164 | VBC | 0.8984 |
165 | 1HR | 0.8981 |
166 | AJG | 0.8979 |
167 | H35 | 0.8979 |
168 | P4L | 0.8979 |
169 | Q0K | 0.8979 |
170 | 1FE | 0.8976 |
171 | VJJ | 0.8975 |
172 | MW5 | 0.8973 |
173 | 0J4 | 0.8973 |
174 | MMS | 0.8971 |
175 | EYJ | 0.8970 |
176 | IQQ | 0.8967 |
177 | 0QV | 0.8966 |
178 | H75 | 0.8964 |
179 | OA1 | 0.8963 |
180 | KYN | 0.8961 |
181 | MP5 | 0.8961 |
182 | CU8 | 0.8961 |
183 | OA4 | 0.8959 |
184 | BZM | 0.8959 |
185 | G6P | 0.8959 |
186 | 5OO | 0.8958 |
187 | LVY | 0.8957 |
188 | F52 | 0.8955 |
189 | WLH | 0.8954 |
190 | VT3 | 0.8954 |
191 | M3W | 0.8952 |
192 | NEU | 0.8952 |
193 | 1BW | 0.8951 |
194 | C82 | 0.8951 |
195 | LWS | 0.8950 |
196 | Q5M | 0.8949 |
197 | 3D1 | 0.8947 |
198 | 7FU | 0.8947 |
199 | 5V7 | 0.8946 |
200 | AMR | 0.8946 |
201 | XCG | 0.8945 |
202 | AUG | 0.8944 |
203 | 20D | 0.8942 |
204 | AUE | 0.8941 |
205 | 5B2 | 0.8940 |
206 | 2UB | 0.8940 |
207 | 272 | 0.8939 |
208 | 4FF | 0.8939 |
209 | 5E5 | 0.8937 |
210 | G30 | 0.8936 |
211 | 4GU | 0.8935 |
212 | HA6 | 0.8930 |
213 | X6P | 0.8929 |
214 | JYT | 0.8929 |
215 | 1SF | 0.8929 |
216 | L1T | 0.8928 |
217 | VM1 | 0.8927 |
218 | S0F | 0.8927 |
219 | 9FG | 0.8925 |
220 | KLS | 0.8924 |
221 | ZON | 0.8924 |
222 | 0OY | 0.8923 |
223 | FCD | 0.8923 |
224 | Y3L | 0.8922 |
225 | 3L1 | 0.8918 |
226 | DHC | 0.8917 |
227 | 4Z9 | 0.8915 |
228 | 3WK | 0.8914 |
229 | EZL | 0.8914 |
230 | PLR | 0.8914 |
231 | 6EL | 0.8913 |
232 | 5NN | 0.8912 |
233 | 22L | 0.8911 |
234 | EQA | 0.8911 |
235 | 4EU | 0.8911 |
236 | 6C5 | 0.8911 |
237 | 4MP | 0.8909 |
238 | WVV | 0.8908 |
239 | BSA | 0.8904 |
240 | TCC | 0.8904 |
241 | 5C1 | 0.8904 |
242 | J38 | 0.8903 |
243 | A9B | 0.8901 |
244 | RDV | 0.8901 |
245 | BG6 | 0.8900 |
246 | XIF XYP | 0.8899 |
247 | 9KZ | 0.8898 |
248 | MUR | 0.8898 |
249 | 8D6 | 0.8897 |
250 | 2QU | 0.8895 |
251 | TQ3 | 0.8893 |
252 | PQT | 0.8893 |
253 | 1V1 | 0.8892 |
254 | AUV | 0.8891 |
255 | 36M | 0.8889 |
256 | 6FG | 0.8889 |
257 | AC2 | 0.8888 |
258 | PMM | 0.8888 |
259 | 848 | 0.8887 |
260 | 0SY | 0.8885 |
261 | ODK | 0.8885 |
262 | 2D2 | 0.8884 |
263 | 4AF | 0.8884 |
264 | 0ON | 0.8883 |
265 | CUQ | 0.8882 |
266 | W23 | 0.8880 |
267 | DAH | 0.8880 |
268 | 7EL | 0.8877 |
269 | QMS | 0.8877 |
270 | NFZ | 0.8877 |
271 | GZV | 0.8876 |
272 | GXG | 0.8873 |
273 | 6XC | 0.8871 |
274 | LRW | 0.8870 |
275 | 7ZO | 0.8869 |
276 | CFA | 0.8869 |
277 | N1E | 0.8867 |
278 | E3X | 0.8867 |
279 | M78 | 0.8865 |
280 | LZJ | 0.8864 |
281 | D1G | 0.8863 |
282 | XYP XYP | 0.8863 |
283 | A73 | 0.8861 |
284 | EQW | 0.8861 |
285 | DFV | 0.8860 |
286 | TI7 | 0.8859 |
287 | HC4 | 0.8858 |
288 | PNP | 0.8856 |
289 | TYR | 0.8856 |
290 | E9S | 0.8856 |
291 | IMH | 0.8856 |
292 | SBK | 0.8854 |
293 | HWH | 0.8854 |
294 | FMQ | 0.8854 |
295 | NYJ | 0.8854 |
296 | X2M | 0.8852 |
297 | KF5 | 0.8850 |
298 | MD6 | 0.8848 |
299 | 531 | 0.8848 |
300 | 92O | 0.8848 |
301 | 4G2 | 0.8848 |
302 | LL1 | 0.8846 |
303 | K48 | 0.8845 |
304 | 6JO | 0.8845 |
305 | 4AU | 0.8845 |
306 | FER | 0.8845 |
307 | P9E | 0.8845 |
308 | S7D | 0.8844 |
309 | 3GX | 0.8844 |
310 | DDC | 0.8842 |
311 | RFZ | 0.8841 |
312 | OLU | 0.8840 |
313 | B61 | 0.8839 |
314 | 1EB | 0.8839 |
315 | QIV | 0.8839 |
316 | IS2 | 0.8838 |
317 | Y4L | 0.8838 |
318 | TXW | 0.8837 |
319 | JFS | 0.8836 |
320 | A7Q | 0.8835 |
321 | 3WO | 0.8833 |
322 | 3WN | 0.8833 |
323 | TPM | 0.8832 |
324 | IYR | 0.8828 |
325 | 5VU | 0.8828 |
326 | BB4 | 0.8828 |
327 | EF2 | 0.8825 |
328 | EAT | 0.8824 |
329 | 9JH | 0.8823 |
330 | 5F1 | 0.8820 |
331 | YF3 | 0.8819 |
332 | 0J2 | 0.8817 |
333 | K82 | 0.8816 |
334 | 5WK | 0.8816 |
335 | JYK | 0.8814 |
336 | MIL | 0.8809 |
337 | NAG | 0.8809 |
338 | 4FE | 0.8807 |
339 | JPQ | 0.8807 |
340 | EYV | 0.8806 |
341 | DJN | 0.8805 |
342 | A5K | 0.8804 |
343 | PUE | 0.8804 |
344 | 4YZ | 0.8802 |
345 | JOB | 0.8801 |
346 | ZEA | 0.8800 |
347 | 397 | 0.8798 |
348 | NEO | 0.8798 |
349 | J4K | 0.8798 |
350 | 14N | 0.8798 |
351 | 6DE | 0.8796 |
352 | 42R | 0.8793 |
353 | 3WJ | 0.8793 |
354 | 6WR | 0.8791 |
355 | TCR | 0.8791 |
356 | ARJ | 0.8788 |
357 | JO5 | 0.8787 |
358 | ET0 | 0.8787 |
359 | T03 | 0.8785 |
360 | WA2 | 0.8784 |
361 | NKI | 0.8782 |
362 | LZ5 | 0.8781 |
363 | PV4 | 0.8779 |
364 | OJD | 0.8779 |
365 | BGN | 0.8777 |
366 | NY4 | 0.8777 |
367 | NOC | 0.8774 |
368 | YIH | 0.8774 |
369 | KLV | 0.8772 |
370 | GEN | 0.8772 |
371 | 6C9 | 0.8772 |
372 | 0XR | 0.8771 |
373 | 7PS | 0.8771 |
374 | SSY | 0.8770 |
375 | ZEZ | 0.8768 |
376 | LI7 | 0.8768 |
377 | 3IP | 0.8768 |
378 | 5M2 | 0.8766 |
379 | 5O5 | 0.8765 |
380 | 4Z1 | 0.8765 |
381 | S7G | 0.8765 |
382 | S0D | 0.8763 |
383 | 536 | 0.8761 |
384 | 2L1 | 0.8757 |
385 | 2LT | 0.8756 |
386 | E6Q | 0.8756 |
387 | P93 | 0.8756 |
388 | 7G1 | 0.8754 |
389 | FWD | 0.8754 |
390 | 6HP | 0.8754 |
391 | GO8 | 0.8753 |
392 | NOS | 0.8751 |
393 | TOH | 0.8751 |
394 | L07 | 0.8751 |
395 | CDJ | 0.8751 |
396 | F4U | 0.8749 |
397 | W8L | 0.8748 |
398 | 789 | 0.8748 |
399 | A6P | 0.8747 |
400 | 0OP | 0.8745 |
401 | PUR | 0.8743 |
402 | FM2 | 0.8743 |
403 | ZIP | 0.8743 |
404 | XYP XIF | 0.8740 |
405 | P2L | 0.8738 |
406 | 14W | 0.8736 |
407 | BBY | 0.8734 |
408 | LZB | 0.8734 |
409 | 1QV | 0.8733 |
410 | NFM | 0.8731 |
411 | BXZ | 0.8731 |
412 | 3VQ | 0.8730 |
413 | EMU | 0.8730 |
414 | AJ4 | 0.8729 |
415 | 1AJ | 0.8729 |
416 | 0OM | 0.8728 |
417 | 3WL | 0.8727 |
418 | YIP | 0.8726 |
419 | 4K2 | 0.8725 |
420 | 22F | 0.8725 |
421 | 5DE | 0.8725 |
422 | EES | 0.8724 |
423 | AGI | 0.8724 |
424 | THU | 0.8723 |
425 | 8CC | 0.8722 |
426 | 8Y7 | 0.8722 |
427 | S62 | 0.8721 |
428 | XIL | 0.8720 |
429 | A4N | 0.8717 |
430 | XDL XYP | 0.8715 |
431 | JTF | 0.8715 |
432 | CWD | 0.8714 |
433 | 12R | 0.8713 |
434 | A7H | 0.8713 |
435 | 2KU | 0.8712 |
436 | 5I5 | 0.8711 |
437 | 0OO | 0.8710 |
438 | XYP XDN | 0.8710 |
439 | 5OR | 0.8710 |
440 | J84 | 0.8710 |
441 | 7MW | 0.8708 |
442 | ZZA | 0.8705 |
443 | Y70 | 0.8701 |
444 | 1QP | 0.8701 |
445 | C2M | 0.8701 |
446 | H0V | 0.8701 |
447 | 5O6 | 0.8700 |
448 | GHQ | 0.8699 |
449 | W1G | 0.8699 |
450 | LR8 | 0.8699 |
451 | 3TC | 0.8698 |
452 | FF2 | 0.8698 |
453 | L3L | 0.8697 |
454 | PXP | 0.8697 |
455 | ZRK | 0.8694 |
456 | TRF | 0.8694 |
457 | 1XS | 0.8693 |
458 | 57D | 0.8689 |
459 | AU8 | 0.8687 |
460 | STV | 0.8685 |
461 | GJK | 0.8684 |
462 | 4UM | 0.8682 |
463 | QH3 | 0.8682 |
464 | 6ZW | 0.8682 |
465 | BWD | 0.8681 |
466 | 5H6 | 0.8681 |
467 | PZX | 0.8680 |
468 | FHV | 0.8680 |
469 | 5CD | 0.8679 |
470 | GJB | 0.8678 |
471 | 7N8 | 0.8677 |
472 | 3AD | 0.8676 |
473 | GA2 | 0.8675 |
474 | PF1 | 0.8675 |
475 | 49P | 0.8674 |
476 | VUP | 0.8674 |
477 | ETV | 0.8674 |
478 | 40N | 0.8673 |
479 | MUX | 0.8673 |
480 | 5WM | 0.8672 |
481 | 51Y | 0.8671 |
482 | XEV | 0.8670 |
483 | U7E | 0.8669 |
484 | N2Y | 0.8668 |
485 | 3JC | 0.8666 |
486 | 68A | 0.8666 |
487 | ML1 | 0.8665 |
488 | 0QA | 0.8663 |
489 | ZTW | 0.8662 |
490 | DE7 | 0.8661 |
491 | S8G | 0.8660 |
492 | 22T | 0.8660 |
493 | STZ | 0.8659 |
494 | 7G0 | 0.8659 |
495 | 1A5 | 0.8659 |
496 | AD3 | 0.8657 |
497 | JF5 | 0.8653 |
498 | TGW | 0.8653 |
499 | LFQ | 0.8652 |
500 | L12 | 0.8648 |
501 | EVO | 0.8648 |
502 | RKN | 0.8646 |
503 | MI2 | 0.8644 |
504 | 5FD | 0.8644 |
505 | 47V | 0.8644 |
506 | SU9 | 0.8643 |
507 | KMP | 0.8643 |
508 | Z21 | 0.8642 |
509 | 3QI | 0.8642 |
510 | NIP | 0.8641 |
511 | S8P | 0.8639 |
512 | 6JM | 0.8637 |
513 | QUB | 0.8637 |
514 | XYS XYP | 0.8636 |
515 | DIH | 0.8634 |
516 | 4L2 | 0.8630 |
517 | 6J5 | 0.8630 |
518 | RF2 | 0.8629 |
519 | MFZ | 0.8627 |
520 | 28A | 0.8623 |
521 | LVP | 0.8620 |
522 | 5ZM | 0.8619 |
523 | C93 | 0.8619 |
524 | 9B3 | 0.8614 |
525 | 17M | 0.8613 |
526 | KWV | 0.8610 |
527 | XDN XYP | 0.8609 |
528 | 7PJ | 0.8606 |
529 | PPN | 0.8606 |
530 | PH3 | 0.8605 |
531 | 78P | 0.8603 |
532 | 3XR | 0.8598 |
533 | NAR | 0.8594 |
534 | 0A1 | 0.8592 |
535 | PTB | 0.8587 |
536 | UA2 | 0.8587 |
537 | HXY | 0.8587 |
538 | D8Q | 0.8586 |
539 | J1K | 0.8586 |
540 | J27 | 0.8585 |
541 | BMC | 0.8583 |
542 | ERZ | 0.8582 |
543 | 6SD | 0.8580 |
544 | MJW | 0.8576 |
545 | 6P3 | 0.8575 |
546 | 5NR | 0.8572 |
547 | ML2 | 0.8567 |
548 | C09 | 0.8565 |
549 | F90 | 0.8564 |
550 | JXQ | 0.8562 |
551 | SX2 | 0.8561 |
552 | P7V | 0.8550 |
553 | 9X3 | 0.8545 |
554 | 9E3 | 0.8543 |
555 | 3XH | 0.8539 |
556 | MPP | 0.8531 |
557 | 2L2 | 0.8527 |
558 | S0A | 0.8523 |
559 | 92Y | 0.8516 |
560 | MQ1 | 0.8506 |
This union binding pocket(no: 1) in the query (biounit: 2nw9.bio1) has 13 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 2nw9.bio1) has 13 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |