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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 8 families. | |||||
1 | 5M19 | - | MUR | C9 H17 N O7 | C[C@H](C(=.... |
2 | 6Q9N | - | MUR | C9 H17 N O7 | C[C@H](C(=.... |
3 | 3ZFZ | - | MUR | C9 H17 N O7 | C[C@H](C(=.... |
4 | 5M18 | - | MUR | C9 H17 N O7 | C[C@H](C(=.... |
5 | 4CJN | Kd = 17.5 uM | QNZ | C24 H15 N3 O3 | c1ccc2c(c1.... |
6 | 5M1A | - | MUR | C9 H17 N O7 | C[C@H](C(=.... |
7 | 4CPK | - | MUR | C9 H17 N O7 | C[C@H](C(=.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 7 families. | |||||
1 | 5M19 | - | MUR | C9 H17 N O7 | C[C@H](C(=.... |
2 | 6Q9N | - | MUR | C9 H17 N O7 | C[C@H](C(=.... |
3 | 3ZFZ | - | MUR | C9 H17 N O7 | C[C@H](C(=.... |
4 | 5M18 | - | MUR | C9 H17 N O7 | C[C@H](C(=.... |
5 | 4CJN | Kd = 17.5 uM | QNZ | C24 H15 N3 O3 | c1ccc2c(c1.... |
6 | 5M1A | - | MUR | C9 H17 N O7 | C[C@H](C(=.... |
7 | 4CPK | - | MUR | C9 H17 N O7 | C[C@H](C(=.... |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | XM5 | 0.9310 |
2 | BGN | 0.9281 |
3 | P9I | 0.9245 |
4 | 878 | 0.9230 |
5 | JR2 | 0.9227 |
6 | 3Y7 | 0.9219 |
7 | F5C | 0.9192 |
8 | AJD | 0.9175 |
9 | 5OF | 0.9173 |
10 | NAG | 0.9158 |
11 | BGU | 0.9154 |
12 | 1BW | 0.9145 |
13 | QMS | 0.9139 |
14 | 2GQ | 0.9113 |
15 | 2JK | 0.9102 |
16 | RVE | 0.9093 |
17 | NCV | 0.9082 |
18 | OTA | 0.9081 |
19 | GZV | 0.9078 |
20 | 7L4 | 0.9071 |
21 | 5P3 | 0.9062 |
22 | XFE | 0.9057 |
23 | TR4 | 0.9054 |
24 | BHS | 0.9053 |
25 | 344 | 0.9053 |
26 | SIZ | 0.9046 |
27 | 96R | 0.9038 |
28 | WUB | 0.9027 |
29 | F40 | 0.9026 |
30 | EXL | 0.9026 |
31 | LP8 | 0.9018 |
32 | BNX | 0.9017 |
33 | KP2 | 0.9014 |
34 | JP2 | 0.9012 |
35 | 9F8 | 0.9007 |
36 | YX1 | 0.9005 |
37 | 7I2 | 0.9005 |
38 | CKA | 0.9005 |
39 | BZE | 0.9002 |
40 | B4O | 0.8999 |
41 | P4L | 0.8997 |
42 | 977 | 0.8990 |
43 | QZ8 | 0.8988 |
44 | 7M5 | 0.8987 |
45 | BA5 | 0.8980 |
46 | 7M2 | 0.8977 |
47 | GF4 | 0.8973 |
48 | NOK | 0.8972 |
49 | 6J3 | 0.8971 |
50 | II4 | 0.8970 |
51 | DXK | 0.8970 |
52 | 692 | 0.8968 |
53 | VXX | 0.8959 |
54 | VM1 | 0.8955 |
55 | AKD | 0.8954 |
56 | A1Y | 0.8952 |
57 | K3Y | 0.8952 |
58 | BIO | 0.8950 |
59 | AXX | 0.8947 |
60 | NLA | 0.8946 |
61 | 22L | 0.8945 |
62 | AH6 | 0.8944 |
63 | 9CE | 0.8941 |
64 | 6J9 | 0.8941 |
65 | AH9 | 0.8936 |
66 | M3E | 0.8931 |
67 | 9UL | 0.8930 |
68 | 68A | 0.8929 |
69 | W8G | 0.8927 |
70 | 6PB | 0.8926 |
71 | OSB | 0.8924 |
72 | 8NX | 0.8923 |
73 | L3L | 0.8922 |
74 | 4KL | 0.8921 |
75 | 54X | 0.8918 |
76 | N0Z | 0.8918 |
77 | H70 | 0.8915 |
78 | 5FL | 0.8915 |
79 | 5F8 | 0.8913 |
80 | NDG | 0.8912 |
81 | MXD | 0.8910 |
82 | IQZ | 0.8907 |
83 | BPY | 0.8904 |
84 | KYA | 0.8904 |
85 | GNV | 0.8904 |
86 | FDR | 0.8900 |
87 | BQ5 | 0.8899 |
88 | BY5 | 0.8899 |
89 | FT6 | 0.8898 |
90 | S98 | 0.8897 |
91 | 9AP | 0.8896 |
92 | LDR | 0.8895 |
93 | 6ZW | 0.8894 |
94 | LIP | 0.8893 |
95 | 2WU | 0.8891 |
96 | ROI | 0.8889 |
97 | DNA | 0.8888 |
98 | 4GP | 0.8888 |
99 | IA2 | 0.8883 |
100 | H4B | 0.8882 |
101 | S7B | 0.8881 |
102 | XZ8 | 0.8879 |
103 | 2LT | 0.8878 |
104 | HHS | 0.8878 |
105 | FLV | 0.8877 |
106 | 7AP | 0.8877 |
107 | GDL | 0.8875 |
108 | B23 | 0.8868 |
109 | 8MO | 0.8867 |
110 | JTA | 0.8867 |
111 | S3P | 0.8867 |
112 | CCV | 0.8865 |
113 | I4D | 0.8864 |
114 | PMP | 0.8863 |
115 | 30G | 0.8863 |
116 | AY4 | 0.8861 |
117 | DPT | 0.8861 |
118 | WS7 | 0.8861 |
119 | 5TZ | 0.8861 |
120 | DX3 | 0.8860 |
121 | X11 | 0.8860 |
122 | 9H2 | 0.8858 |
123 | 5WT | 0.8858 |
124 | PLP | 0.8857 |
125 | 5V7 | 0.8856 |
126 | M3Q | 0.8856 |
127 | MPU | 0.8855 |
128 | TRP | 0.8855 |
129 | HH6 | 0.8854 |
130 | 8HH | 0.8854 |
131 | 96Z | 0.8851 |
132 | B21 | 0.8850 |
133 | S60 | 0.8849 |
134 | LOG | 0.8848 |
135 | OCZ | 0.8848 |
136 | 64C | 0.8847 |
137 | 5F5 | 0.8846 |
138 | GI4 | 0.8845 |
139 | 1V4 | 0.8842 |
140 | THA | 0.8842 |
141 | AA | 0.8841 |
142 | 5VJ | 0.8841 |
143 | KLV | 0.8841 |
144 | MIL | 0.8840 |
145 | ANF | 0.8838 |
146 | 25F | 0.8837 |
147 | A73 | 0.8837 |
148 | KDO | 0.8837 |
149 | SG2 | 0.8836 |
150 | 55D | 0.8835 |
151 | Q0K | 0.8833 |
152 | 0XT | 0.8833 |
153 | 4NR | 0.8833 |
154 | B2T | 0.8832 |
155 | AVX | 0.8832 |
156 | 20D | 0.8831 |
157 | 4F8 | 0.8830 |
158 | 6FB | 0.8829 |
159 | PVK | 0.8828 |
160 | OUB | 0.8828 |
161 | 8NB | 0.8825 |
162 | DX7 | 0.8825 |
163 | 78P | 0.8823 |
164 | DFL | 0.8823 |
165 | PBQ | 0.8822 |
166 | 1V1 | 0.8822 |
167 | AVA | 0.8821 |
168 | KJ5 | 0.8820 |
169 | BG6 | 0.8819 |
170 | Q5M | 0.8818 |
171 | 6QF | 0.8818 |
172 | PVQ | 0.8816 |
173 | CGW | 0.8816 |
174 | 0GA | 0.8815 |
175 | M5H | 0.8814 |
176 | BGP | 0.8814 |
177 | RB2 | 0.8814 |
178 | KGK | 0.8814 |
179 | ANC | 0.8813 |
180 | 537 | 0.8812 |
181 | 3J8 | 0.8810 |
182 | K48 | 0.8809 |
183 | LFQ | 0.8807 |
184 | 6DQ | 0.8807 |
185 | 0J5 | 0.8806 |
186 | BP3 | 0.8806 |
187 | DBQ | 0.8805 |
188 | PXP | 0.8802 |
189 | 61O | 0.8802 |
190 | GNY | 0.8801 |
191 | MPP | 0.8801 |
192 | MBP | 0.8801 |
193 | NEU | 0.8800 |
194 | 6ME | 0.8800 |
195 | DNQ | 0.8800 |
196 | DDU | 0.8799 |
197 | 44V | 0.8799 |
198 | 92P | 0.8799 |
199 | X0T | 0.8798 |
200 | V1T | 0.8798 |
201 | HHR | 0.8798 |
202 | PH2 | 0.8798 |
203 | OQC | 0.8797 |
204 | 4Z1 | 0.8797 |
205 | N88 | 0.8797 |
206 | MZM | 0.8797 |
207 | C93 | 0.8796 |
208 | H2B | 0.8795 |
209 | G6P | 0.8795 |
210 | BIE | 0.8790 |
211 | CPW | 0.8789 |
212 | BPU | 0.8789 |
213 | 2K8 | 0.8788 |
214 | 78Y | 0.8788 |
215 | 0W1 | 0.8787 |
216 | 67X | 0.8787 |
217 | 2D3 | 0.8787 |
218 | JY4 | 0.8787 |
219 | CHQ | 0.8786 |
220 | YTX | 0.8786 |
221 | 4GU | 0.8784 |
222 | H5B | 0.8784 |
223 | DRG | 0.8784 |
224 | ZYR | 0.8783 |
225 | RH1 | 0.8781 |
226 | IK1 | 0.8780 |
227 | 5E4 | 0.8780 |
228 | SER DNF | 0.8780 |
229 | DNF SER | 0.8780 |
230 | CK2 | 0.8779 |
231 | CNI | 0.8778 |
232 | 92O | 0.8775 |
233 | MMJ | 0.8775 |
234 | O2Y | 0.8775 |
235 | 4FF | 0.8774 |
236 | 0OK | 0.8774 |
237 | EV2 | 0.8773 |
238 | HRM | 0.8773 |
239 | LL1 | 0.8771 |
240 | Q9P | 0.8771 |
241 | M6P | 0.8770 |
242 | 3F4 | 0.8770 |
243 | DNC | 0.8769 |
244 | M02 | 0.8768 |
245 | F2W | 0.8767 |
246 | 3D8 | 0.8766 |
247 | KWB | 0.8766 |
248 | GNJ | 0.8766 |
249 | MQG | 0.8764 |
250 | C8O | 0.8764 |
251 | K44 | 0.8763 |
252 | 5GL | 0.8763 |
253 | YO5 | 0.8762 |
254 | 4RU | 0.8762 |
255 | EWG | 0.8762 |
256 | CR1 | 0.8761 |
257 | 1QV | 0.8761 |
258 | 0J4 | 0.8760 |
259 | GJP | 0.8760 |
260 | 6DP | 0.8759 |
261 | EYA | 0.8759 |
262 | UQ1 | 0.8759 |
263 | OKM | 0.8758 |
264 | JWS | 0.8757 |
265 | EVO | 0.8757 |
266 | 2UZ | 0.8756 |
267 | HBI | 0.8756 |
268 | SZ5 | 0.8755 |
269 | L1T | 0.8754 |
270 | NIY | 0.8754 |
271 | P0P | 0.8752 |
272 | 6GP | 0.8751 |
273 | CG8 | 0.8750 |
274 | LZ2 | 0.8749 |
275 | BBY | 0.8749 |
276 | PEY | 0.8749 |
277 | CE2 | 0.8749 |
278 | I59 | 0.8749 |
279 | 1V3 | 0.8749 |
280 | LEL | 0.8748 |
281 | NWD | 0.8748 |
282 | MUK | 0.8747 |
283 | BOQ | 0.8746 |
284 | YZ9 | 0.8746 |
285 | 6JO | 0.8743 |
286 | X04 | 0.8742 |
287 | EYM | 0.8741 |
288 | JSX | 0.8741 |
289 | 3WJ | 0.8740 |
290 | IPT | 0.8740 |
291 | 2D2 | 0.8739 |
292 | C9E | 0.8739 |
293 | RKV | 0.8738 |
294 | 2GD | 0.8738 |
295 | CU8 | 0.8736 |
296 | L21 | 0.8735 |
297 | 8HC | 0.8735 |
298 | E1K | 0.8735 |
299 | PLR | 0.8735 |
300 | TGW | 0.8732 |
301 | FUZ | 0.8732 |
302 | CLZ | 0.8732 |
303 | PRL | 0.8731 |
304 | EGR | 0.8731 |
305 | 3DE | 0.8731 |
306 | 3DT | 0.8731 |
307 | SNG | 0.8729 |
308 | 27B | 0.8729 |
309 | 549 | 0.8729 |
310 | 7VF | 0.8729 |
311 | GHM | 0.8728 |
312 | Q4G | 0.8727 |
313 | L5E | 0.8727 |
314 | B56 | 0.8727 |
315 | CX4 | 0.8727 |
316 | TCR | 0.8725 |
317 | GI1 | 0.8724 |
318 | TLF | 0.8724 |
319 | IPD | 0.8723 |
320 | NGA | 0.8723 |
321 | RGK | 0.8723 |
322 | CTN | 0.8723 |
323 | S3C | 0.8721 |
324 | 5JT | 0.8721 |
325 | 5WM | 0.8720 |
326 | AMR | 0.8720 |
327 | 1FE | 0.8720 |
328 | GI3 | 0.8719 |
329 | ZME | 0.8719 |
330 | 4AB | 0.8718 |
331 | TWO | 0.8716 |
332 | XQK | 0.8715 |
333 | S0G | 0.8715 |
334 | K25 | 0.8714 |
335 | SSM | 0.8713 |
336 | 4R1 | 0.8712 |
337 | DDC | 0.8712 |
338 | PYU | 0.8712 |
339 | 6NZ | 0.8711 |
340 | D6G | 0.8709 |
341 | CUT | 0.8708 |
342 | 7FF | 0.8706 |
343 | 582 | 0.8706 |
344 | CRB | 0.8705 |
345 | WLH | 0.8704 |
346 | 363 | 0.8704 |
347 | 3QV | 0.8703 |
348 | 51Y | 0.8701 |
349 | ZIQ | 0.8701 |
350 | 5NN | 0.8701 |
351 | MNS | 0.8701 |
352 | 3GX | 0.8700 |
353 | 1KP | 0.8699 |
354 | IQW | 0.8697 |
355 | WS6 | 0.8696 |
356 | BBK | 0.8696 |
357 | ZSP | 0.8696 |
358 | ZYQ | 0.8695 |
359 | M1Z | 0.8695 |
360 | IQ5 | 0.8695 |
361 | OX2 | 0.8694 |
362 | B52 | 0.8694 |
363 | 5NS | 0.8693 |
364 | MW5 | 0.8693 |
365 | THM | 0.8692 |
366 | X48 | 0.8691 |
367 | 5GT | 0.8690 |
368 | B62 | 0.8690 |
369 | YE7 | 0.8689 |
370 | 4XY | 0.8687 |
371 | AC2 | 0.8687 |
372 | CX6 | 0.8686 |
373 | K97 | 0.8686 |
374 | 8VR | 0.8685 |
375 | 9GP | 0.8684 |
376 | 8XL | 0.8684 |
377 | ID8 | 0.8684 |
378 | 57D | 0.8683 |
379 | HPT | 0.8683 |
380 | NBG | 0.8683 |
381 | V2Z | 0.8682 |
382 | NIR | 0.8681 |
383 | PLP PMP | 0.8681 |
384 | 3AK | 0.8681 |
385 | 14W | 0.8680 |
386 | DQU | 0.8680 |
387 | 0LO | 0.8680 |
388 | 6KT | 0.8679 |
389 | 0FR | 0.8679 |
390 | WSD | 0.8679 |
391 | ABJ | 0.8679 |
392 | 2LY | 0.8677 |
393 | QX4 | 0.8677 |
394 | 49P | 0.8677 |
395 | GRX | 0.8676 |
396 | 0FK | 0.8676 |
397 | AH3 | 0.8675 |
398 | 60L | 0.8675 |
399 | ARP | 0.8675 |
400 | 3SU | 0.8675 |
401 | JG8 | 0.8674 |
402 | 4A1 | 0.8673 |
403 | 4WF | 0.8673 |
404 | 4ME | 0.8673 |
405 | NGS | 0.8672 |
406 | 67Y | 0.8671 |
407 | AM1 | 0.8671 |
408 | TIY | 0.8670 |
409 | FWD | 0.8669 |
410 | 1QP | 0.8669 |
411 | KTW | 0.8668 |
412 | DY5 | 0.8666 |
413 | APS | 0.8664 |
414 | EXD | 0.8663 |
415 | IWD | 0.8663 |
416 | K3Q | 0.8661 |
417 | 28N | 0.8661 |
418 | M6D | 0.8660 |
419 | NIF | 0.8660 |
420 | TRU | 0.8660 |
421 | ZYV | 0.8660 |
422 | NYJ | 0.8659 |
423 | CH9 | 0.8657 |
424 | TT4 | 0.8657 |
425 | 3XR | 0.8656 |
426 | 8WO | 0.8655 |
427 | SXX | 0.8654 |
428 | IBM | 0.8654 |
429 | N2M | 0.8652 |
430 | 0UL | 0.8651 |
431 | U7E | 0.8651 |
432 | K7H | 0.8649 |
433 | FER | 0.8649 |
434 | X2M | 0.8647 |
435 | 6HP | 0.8647 |
436 | 89J | 0.8646 |
437 | GNM | 0.8646 |
438 | EUE | 0.8646 |
439 | LDC | 0.8645 |
440 | 9FL | 0.8645 |
441 | QIF | 0.8644 |
442 | WOE | 0.8644 |
443 | HNA | 0.8642 |
444 | GLP | 0.8642 |
445 | 57O | 0.8642 |
446 | X6W | 0.8641 |
447 | KMY | 0.8641 |
448 | DUR | 0.8641 |
449 | 6TJ | 0.8640 |
450 | NPL | 0.8639 |
451 | 4I8 | 0.8639 |
452 | FTV | 0.8635 |
453 | S1D | 0.8635 |
454 | HBO | 0.8632 |
455 | F6P | 0.8631 |
456 | MOK | 0.8631 |
457 | 5E5 | 0.8631 |
458 | KFN | 0.8631 |
459 | BWD | 0.8630 |
460 | HNT | 0.8630 |
461 | 5I5 | 0.8630 |
462 | CH8 | 0.8629 |
463 | A2G | 0.8627 |
464 | U5A | 0.8626 |
465 | 15E | 0.8626 |
466 | GA2 | 0.8626 |
467 | HMD | 0.8626 |
468 | S0E | 0.8625 |
469 | HJB | 0.8625 |
470 | CWD | 0.8625 |
471 | H35 | 0.8625 |
472 | C2Y | 0.8619 |
473 | 2KA | 0.8619 |
474 | 1X8 | 0.8618 |
475 | EN1 | 0.8618 |
476 | 555 | 0.8615 |
477 | GO8 | 0.8614 |
478 | MUX | 0.8613 |
479 | ALX | 0.8613 |
480 | IOS | 0.8611 |
481 | D3G | 0.8611 |
482 | WVV | 0.8611 |
483 | 0JD | 0.8609 |
484 | GC2 | 0.8609 |
485 | 6QT | 0.8609 |
486 | 4BY | 0.8608 |
487 | GL1 | 0.8608 |
488 | J38 | 0.8607 |
489 | 54E | 0.8604 |
490 | T6Z | 0.8603 |
491 | RA7 | 0.8602 |
492 | FF2 | 0.8602 |
493 | XQI | 0.8602 |
494 | 21D | 0.8601 |
495 | AQ1 | 0.8600 |
496 | 6DE | 0.8600 |
497 | 7ME | 0.8599 |
498 | 15Q | 0.8597 |
499 | 8DA | 0.8596 |
500 | NTF | 0.8596 |
501 | 1A7 | 0.8596 |
502 | 5AD | 0.8595 |
503 | X0U | 0.8594 |
504 | IOP | 0.8593 |
505 | DT9 | 0.8593 |
506 | 5GV | 0.8591 |
507 | VK3 | 0.8591 |
508 | GL6 | 0.8587 |
509 | ZRL | 0.8587 |
510 | ZRK | 0.8586 |
511 | ACE TRP | 0.8586 |
512 | 38B | 0.8586 |
513 | CP6 | 0.8583 |
514 | SJK | 0.8582 |
515 | MJ5 | 0.8578 |
516 | MMS | 0.8576 |
517 | AWE | 0.8575 |
518 | KCH | 0.8575 |
519 | 3JM | 0.8574 |
520 | DK1 | 0.8574 |
521 | 3UG | 0.8572 |
522 | 15N | 0.8572 |
523 | X6P | 0.8572 |
524 | 272 | 0.8570 |
525 | VBC | 0.8569 |
526 | M3W | 0.8567 |
527 | PJW | 0.8563 |
528 | L22 | 0.8563 |
529 | F6R | 0.8562 |
530 | 5VU | 0.8562 |
531 | D2G | 0.8562 |
532 | FMQ | 0.8562 |
533 | KMP | 0.8561 |
534 | E9P | 0.8560 |
535 | 1PL | 0.8559 |
536 | STT | 0.8555 |
537 | NRA | 0.8555 |
538 | IAC | 0.8551 |
539 | ADA | 0.8547 |
540 | PQZ | 0.8547 |
541 | E35 | 0.8546 |
542 | CSN | 0.8544 |
543 | GTV | 0.8543 |
544 | TXQ | 0.8543 |
545 | 3WK | 0.8541 |
546 | 982 | 0.8539 |
547 | VT3 | 0.8536 |
548 | 8Y7 | 0.8534 |
549 | 0FN | 0.8532 |
550 | 9OF | 0.8531 |
551 | 3R4 | 0.8529 |
552 | 293 | 0.8529 |
553 | 16Z | 0.8522 |
554 | ETV | 0.8513 |
No: | Ligand | Similarity coefficient |
---|
This union binding pocket(no: 1) in the query (biounit: 4cjn.bio1) has 12 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 4cjn.bio1) has 16 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 3) in the query (biounit: 4cjn.bio1) has 18 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |