Receptor
PDB id Resolution Class Description Source Keywords
6FUK 2 Å EC: 1.14.11.- CRYSTAL STRUCTURE OF UTX COMPLEXED WITH 5-CARBOXY-8-HYDROXYQ HOMO SAPIENS JUMONJI DEMETHYLASE INHIBITOR OXIDOREDUCTASE
Ref.: IN SILICO IDENTIFICATION OF JMJD3 DEMETHYLASE INHIB J CHEM INF MODEL V. 58 2151 2018
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
SO4 A:1504;
A:1505;
 Invalid;
Invalid;
 none;
none;
 submit data
96.063 O4 S [O-]S...
ZN A:1503;
 Part of Protein;
 none;
 submit data
65.409 Zn [Zn+2...
PEG A:1506;
A:1507;
 Invalid;
Invalid;
 none;
none;
 submit data
106.12 C4 H10 O3 C(COC...
PG0 A:1508;
 Invalid;
 none;
 submit data
120.147 C5 H12 O3 COCCO...
MN A:1501;
 Part of Protein;
 none;
 submit data
54.938 Mn [Mn+2...
8XQ A:1502;
 Valid;
 none;
 submit data
189.167 C10 H7 N O3 c1cc2...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
6FUL 1.65 Å EC: 1.14.11.- CRYSTAL STRUCTURE OF UTX COMPLEXED WITH 5-HYDROXY-4-KETO-1-M PICOLINATE HOMO SAPIENS JUMONJI DEMETHYLASE INHIBITOR OXIDOREDUCTASE
Ref.: IN SILICO IDENTIFICATION OF JMJD3 DEMETHYLASE INHIB J CHEM INF MODEL V. 58 2151 2018
Members (4)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 43 families.
1 6FUK - 8XQ C10 H7 N O3 c1cc2c(ccc....
2 3AVS - OGA C4 H5 N O5 C(C(=O)O)N....
3 6G8F - K0I C22 H23 N5 O2 c1ccc2c(c1....
4 6FUL ic50 = 12 uM PG0 C5 H12 O3 COCCOCCO
70% Homology Family (8)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 31 families.
1 4ASK - K0I C22 H23 N5 O2 c1ccc2c(c1....
2 5FP3 ic50 = 1.259 uM YC8 C16 H16 N2 O3 c1ccc(cc1)....
3 4EYU - OGA C4 H5 N O5 C(C(=O)O)N....
4 2XUE - AKG C5 H6 O5 C(CC(=O)O)....
5 6FUK - 8XQ C10 H7 N O3 c1cc2c(ccc....
6 3AVS - OGA C4 H5 N O5 C(C(=O)O)N....
7 6G8F - K0I C22 H23 N5 O2 c1ccc2c(c1....
8 6FUL ic50 = 12 uM PG0 C5 H12 O3 COCCOCCO
50% Homology Family (8)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 28 families.
1 4ASK - K0I C22 H23 N5 O2 c1ccc2c(c1....
2 5FP3 ic50 = 1.259 uM YC8 C16 H16 N2 O3 c1ccc(cc1)....
3 4EYU - OGA C4 H5 N O5 C(C(=O)O)N....
4 2XUE - AKG C5 H6 O5 C(CC(=O)O)....
5 6FUK - 8XQ C10 H7 N O3 c1cc2c(ccc....
6 3AVS - OGA C4 H5 N O5 C(C(=O)O)N....
7 6G8F - K0I C22 H23 N5 O2 c1ccc2c(c1....
8 6FUL ic50 = 12 uM PG0 C5 H12 O3 COCCOCCO
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: 8XQ; Similar ligands found: 2
No: Ligand ECFP6 Tc MDL keys Tc
1 8XQ 1 1
2 HZQ 0.469388 0.7
Similar Ligands (3D)
Ligand no: 1; Ligand: 8XQ; Similar ligands found: 890
No: Ligand Similarity coefficient
1 HNQ 0.9977
2 5WY 0.9767
3 7ZE 0.9724
4 2ZQ 0.9664
5 1X7 0.9662
6 AKH 0.9630
7 ZZ8 0.9624
8 X8D 0.9622
9 3MG 0.9613
10 BDP 0.9603
11 7NI 0.9593
12 NTZ 0.9587
13 PXL 0.9583
14 BGC 0.9581
15 Q6T 0.9580
16 AIN 0.9561
17 G3F 0.9555
18 8S0 0.9549
19 8GK 0.9549
20 EVA 0.9541
21 42C 0.9539
22 6BL 0.9529
23 DNC 0.9526
24 NID 0.9523
25 15L 0.9518
26 QPR 0.9517
27 SYA 0.9511
28 12B 0.9504
29 LGC 0.9504
30 FOT 0.9500
31 DNF 0.9487
32 MHK 0.9484
33 GCB 0.9481
34 M0W 0.9480
35 LI6 0.9480
36 GCS 0.9478
37 FBG 0.9476
38 DPZ 0.9471
39 DBJ 0.9470
40 MT8 0.9469
41 UEG 0.9466
42 9AP 0.9466
43 9KT 0.9465
44 LDR 0.9464
45 KFH 0.9461
46 4ME 0.9455
47 SR4 0.9448
48 IJZ 0.9445
49 5NE 0.9444
50 FLV 0.9444
51 Z5P 0.9442
52 GLC 0.9440
53 QMS 0.9433
54 UNC 0.9431
55 GCU 0.9430
56 TEP 0.9427
57 VNL 0.9422
58 HJP 0.9421
59 K3Q 0.9418
60 M1H 0.9415
61 7VS 0.9412
62 MIG 0.9409
63 209 0.9406
64 226 0.9399
65 GCW 0.9398
66 3C2 0.9397
67 INE 0.9397
68 BK9 0.9396
69 O2A 0.9390
70 HLZ 0.9390
71 TVP 0.9384
72 M0Q 0.9381
73 TSR 0.9379
74 NVU 0.9379
75 KBG 0.9375
76 GTZ 0.9375
77 H33 0.9368
78 92K 0.9364
79 23J 0.9356
80 I6G 0.9354
81 HTP 0.9354
82 BPU 0.9350
83 APZ 0.9349
84 TTY 0.9347
85 3C1 0.9345
86 495 0.9343
87 JTH 0.9341
88 F12 0.9340
89 FE DB1 0.9340
90 5WX 0.9339
91 3IT 0.9338
92 TWO 0.9333
93 5RO 0.9333
94 C2U 0.9333
95 MT0 0.9329
96 8VE 0.9329
97 7WR 0.9321
98 GIM 0.9320
99 YSO 0.9319
100 ICO 0.9317
101 GV9 0.9312
102 AEZ 0.9306
103 MT5 0.9304
104 5OF 0.9303
105 NQ 0.9300
106 JR2 0.9299
107 PFB 0.9298
108 5NS 0.9297
109 SHG 0.9297
110 GOG 0.9297
111 CFF 0.9296
112 IOS 0.9295
113 PDC 0.9291
114 VK3 0.9289
115 X09 0.9288
116 HQD 0.9288
117 KYA 0.9287
118 OA3 0.9286
119 582 0.9286
120 4MU 0.9285
121 RXA 0.9285
122 JKZ 0.9285
123 0N7 0.9277
124 329 0.9271
125 64C 0.9269
126 LZ2 0.9267
127 GAL 0.9267
128 6DP 0.9265
129 M2K 0.9265
130 2J9 0.9264
131 IBM 0.9263
132 KGK 0.9259
133 06B 0.9256
134 JBQ 0.9255
135 M3Q 0.9255
136 7I2 0.9252
137 SRO 0.9251
138 NLA 0.9250
139 67X 0.9248
140 M1E 0.9245
141 JUG 0.9245
142 NDM 0.9244
143 5PX 0.9243
144 GLT 0.9242
145 AZ9 0.9242
146 CLZ 0.9240
147 L7T 0.9238
148 HKD 0.9234
149 MVL 0.9230
150 UAN 0.9229
151 5RN 0.9228
152 4KL 0.9228
153 7ME 0.9228
154 PYQ 0.9227
155 NOJ 0.9221
156 A7W 0.9217
157 NTM 0.9217
158 ASO 0.9216
159 G5V 0.9212
160 7FF 0.9211
161 3WA 0.9209
162 1AL 0.9208
163 2LY 0.9208
164 BNT 0.9200
165 7CT 0.9199
166 680 0.9196
167 ZVO 0.9195
168 UFO 0.9193
169 G1O 0.9191
170 PEY 0.9191
171 5WU 0.9190
172 ARP 0.9186
173 KT7 0.9185
174 D07 0.9184
175 BEA 0.9183
176 TQU 0.9182
177 6XI 0.9181
178 HLD 0.9180
179 HHA 0.9179
180 6R8 0.9177
181 39A 0.9177
182 XM5 0.9175
183 EA1 0.9174
184 F0J 0.9172
185 3RI 0.9171
186 B60 0.9170
187 DIN 0.9170
188 Q24 0.9169
189 APS 0.9167
190 TOF 0.9166
191 AQO 0.9166
192 C2Y 0.9166
193 V55 0.9166
194 AJ2 0.9165
195 7B3 0.9165
196 URC 0.9164
197 DHK 0.9164
198 4AA 0.9163
199 3R6 0.9162
200 M5K 0.9161
201 2FQ 0.9159
202 MEW 0.9158
203 XQG 0.9156
204 8HC 0.9155
205 5VJ 0.9153
206 GDE 0.9153
207 G2F 0.9153
208 PE0 0.9152
209 CN0 0.9151
210 18N 0.9150
211 GOX 0.9149
212 MAQ 0.9146
213 RPQ 0.9144
214 C9E 0.9143
215 9MG 0.9140
216 MB1 0.9139
217 EJZ 0.9138
218 PRZ 0.9137
219 BMA 0.9137
220 MUA 0.9137
221 GTR 0.9136
222 SOR 0.9133
223 MO8 0.9131
224 AY4 0.9130
225 ORO 0.9130
226 GCV 0.9127
227 9PY 0.9126
228 XQK 0.9125
229 4HC 0.9124
230 KIB 0.9124
231 MXX 0.9121
232 GSY 0.9121
233 NGT 0.9121
234 4M4 0.9119
235 EUG 0.9119
236 0W8 0.9119
237 3MA 0.9118
238 NCD 0.9118
239 LKA 0.9117
240 VXX 0.9115
241 3HA 0.9114
242 0GZ 0.9113
243 PX7 0.9112
244 67Y 0.9111
245 PXM 0.9110
246 CTS 0.9110
247 M5N 0.9108
248 NOY 0.9107
249 CBF 0.9104
250 I3A 0.9103
251 DBH 0.9103
252 B62 0.9102
253 4AN 0.9100
254 7HQ 0.9099
255 ADK 0.9098
256 4TU 0.9097
257 0FK 0.9097
258 AZ8 0.9096
259 DIU 0.9094
260 XAZ 0.9093
261 948 0.9092
262 B57 0.9091
263 IFL 0.9090
264 28N 0.9090
265 N8Y 0.9089
266 KJY 0.9088
267 HA7 0.9087
268 VOH 0.9087
269 X05 0.9087
270 GJS 0.9087
271 PHH 0.9087
272 6ME 0.9086
273 4HM 0.9086
274 NGO 0.9084
275 LCN 0.9084
276 37T 0.9084
277 KIA 0.9083
278 OKM 0.9082
279 XHP 0.9081
280 GM7 0.9078
281 MAN 0.9077
282 091 0.9077
283 3MB 0.9076
284 6VD 0.9071
285 AJV 0.9069
286 DOR 0.9069
287 M6N 0.9068
288 ISE 0.9067
289 TIY 0.9067
290 OTW 0.9067
291 GTQ 0.9067
292 8VN 0.9067
293 FXH 0.9066
294 GLA 0.9066
295 2H5 0.9065
296 2D3 0.9065
297 LSA 0.9063
298 J9W 0.9061
299 V6F 0.9061
300 UQ 0.9061
301 1KP 0.9061
302 537 0.9059
303 MRW 0.9059
304 ZB1 0.9059
305 ZWZ 0.9058
306 DQU 0.9058
307 DRL 0.9057
308 54G 0.9056
309 92P 0.9056
310 7M6 0.9055
311 3F0 0.9054
312 3M0 0.9054
313 3TJ 0.9052
314 M1Q 0.9050
315 JBK 0.9048
316 75K 0.9047
317 MBG 0.9042
318 DIE 0.9040
319 2EC 0.9040
320 G12 0.9040
321 44V 0.9040
322 GT0 0.9040
323 OMD 0.9040
324 TBS 0.9039
325 5M0 0.9038
326 8CM 0.9038
327 PQK 0.9037
328 FH2 0.9037
329 TNF 0.9037
330 8WZ 0.9035
331 5JQ 0.9032
332 0P6 0.9029
333 SWA 0.9029
334 H6B 0.9028
335 5RG 0.9027
336 60Q 0.9027
337 KLK 0.9026
338 8TX 0.9026
339 QBK 0.9024
340 82I 0.9023
341 YQA 0.9022
342 5MK 0.9021
343 32X 0.9019
344 GHM 0.9018
345 692 0.9016
346 3DO 0.9014
347 CWS 0.9014
348 293 0.9013
349 TNL 0.9012
350 G1P 0.9009
351 NBG 0.9008
352 ZYR 0.9008
353 HXX 0.9008
354 1GN 0.9007
355 B55 0.9007
356 GIO 0.9005
357 24W 0.9004
358 BTY 0.9003
359 K32 0.9003
360 MVN 0.9003
361 6CS 0.9003
362 2AK 0.9002
363 K22 0.9002
364 FDK 0.9001
365 QAT 0.9001
366 44W 0.9000
367 X6X 0.8999
368 57O 0.8998
369 K17 0.8998
370 54X 0.8998
371 EMZ 0.8997
372 DHQ 0.8997
373 OXC 0.8997
374 QAS 0.8996
375 JG8 0.8996
376 4XH 0.8994
377 HH8 0.8994
378 SHA 0.8991
379 34D 0.8991
380 RM1 0.8990
381 42A 0.8990
382 IAC 0.8990
383 QM1 0.8989
384 GZ8 0.8987
385 KUF 0.8986
386 SXS 0.8986
387 4XV 0.8986
388 I4D 0.8985
389 8W9 0.8985
390 KIF 0.8984
391 HA5 0.8984
392 II6 0.8983
393 AW5 0.8982
394 30G 0.8980
395 2SX 0.8978
396 R8V 0.8976
397 CKX 0.8976
398 OTD 0.8975
399 XFE 0.8975
400 H5B 0.8975
401 2KA 0.8975
402 PHT 0.8974
403 2JK 0.8973
404 M4E 0.8973
405 2FG 0.8973
406 NAG 0.8972
407 D1X 0.8972
408 5QX 0.8972
409 SX1 0.8971
410 TTL 0.8971
411 XAN 0.8970
412 3Z8 0.8970
413 5SG 0.8968
414 FGZ 0.8967
415 ADA 0.8965
416 HQY 0.8965
417 EOL 0.8964
418 7VJ 0.8960
419 FDR 0.8960
420 9KH 0.8959
421 JPZ 0.8959
422 8WO 0.8958
423 FDB 0.8957
424 F31 0.8956
425 512 0.8956
426 DNA 0.8955
427 5IQ 0.8955
428 LZM 0.8955
429 4YS 0.8954
430 IV2 0.8954
431 PQ0 0.8954
432 IPZ 0.8953
433 DQN 0.8953
434 O72 0.8952
435 Q71 0.8952
436 1U6 0.8952
437 0FO 0.8951
438 9DG 0.8951
439 PD2 0.8950
440 DK1 0.8950
441 ES1 0.8950
442 LT8 0.8949
443 W8G 0.8948
444 9UG 0.8948
445 A13 0.8948
446 HQT 0.8947
447 8G0 0.8946
448 N5J 0.8945
449 1SQ 0.8945
450 64E 0.8943
451 8IG 0.8943
452 FLC 0.8942
453 AZA 0.8941
454 TRA 0.8938
455 ES0 0.8938
456 GUN 0.8938
457 4A5 0.8937
458 R9Y 0.8937
459 GNL 0.8937
460 H7Y 0.8937
461 E7R 0.8936
462 QSH 0.8936
463 4XS 0.8936
464 X0W 0.8935
465 1LM 0.8934
466 6AP 0.8934
467 IPT 0.8933
468 1LQ 0.8931
469 1NP 0.8930
470 3GQ 0.8930
471 5Q0 0.8930
472 WOO 0.8929
473 7W1 0.8927
474 5JL 0.8927
475 3Y7 0.8926
476 GIV 0.8926
477 YH7 0.8924
478 4NO 0.8924
479 2AL 0.8923
480 PRF 0.8923
481 PA1 0.8922
482 TRC 0.8921
483 UFV 0.8921
484 INS 0.8919
485 IGA 0.8919
486 NDG 0.8915
487 TFU 0.8915
488 ASC 0.8913
489 KLW 0.8913
490 ROI 0.8912
491 R6T 0.8912
492 VYM 0.8911
493 12Q 0.8910
494 J9Q 0.8908
495 141 0.8908
496 1QP 0.8907
497 CWM 0.8907
498 2D0 0.8905
499 DEE 0.8904
500 XX2 0.8903
501 ZON 0.8903
502 61M 0.8903
503 D3M 0.8902
504 9TZ 0.8900
505 J01 0.8900
506 SJ5 0.8900
507 SOE 0.8899
508 7B4 0.8899
509 AZG 0.8897
510 4XY 0.8896
511 3DM 0.8893
512 97T 0.8893
513 SKM 0.8891
514 12M 0.8891
515 3FH 0.8891
516 QX4 0.8890
517 JBH 0.8890
518 1XM 0.8889
519 Q88 0.8889
520 LYL 0.8888
521 BSP 0.8888
522 QX2 0.8888
523 JU2 0.8887
524 ALL 0.8886
525 ESI 0.8884
526 XXP 0.8883
527 P9P 0.8883
528 6J9 0.8882
529 EV0 0.8882
530 149 0.8881
531 DX4 0.8880
532 DX3 0.8879
533 E7Z 0.8879
534 GTL 0.8878
535 TSS 0.8877
536 0W1 0.8877
537 8NX 0.8876
538 0LH 0.8874
539 JP2 0.8874
540 0CU 0.8873
541 BCF 0.8872
542 LIP 0.8871
543 IFM 0.8870
544 MS9 0.8868
545 49N 0.8867
546 M5H 0.8866
547 HPT 0.8866
548 4Z4 0.8866
549 GZL 0.8866
550 SYR 0.8865
551 SLC 0.8864
552 39O 0.8864
553 T6Z 0.8864
554 ZME 0.8860
555 CIT 0.8860
556 EYA 0.8859
557 DRG 0.8858
558 Q7A 0.8858
559 6GU 0.8858
560 39U 0.8857
561 QSB 0.8857
562 CFP 0.8856
563 HFB 0.8856
564 4NC 0.8855
565 SKA 0.8855
566 MZB 0.8855
567 290 0.8854
568 ADZ 0.8853
569 BBF 0.8852
570 A2F 0.8851
571 K5W 0.8848
572 5VL 0.8848
573 IBF 0.8848
574 BOA 0.8848
575 N3W 0.8848
576 MSN 0.8847
577 PFL 0.8847
578 LT3 0.8844
579 3ID 0.8841
580 2CZ 0.8840
581 0XT 0.8839
582 BRV 0.8839
583 ONR 0.8835
584 GNM 0.8833
585 EXO 0.8833
586 5OB 0.8832
587 NDH 0.8831
588 8WT 0.8830
589 344 0.8830
590 49O 0.8827
591 KG1 0.8824
592 K68 0.8823
593 DHB 0.8820
594 SE2 0.8819
595 8MO 0.8818
596 LAO 0.8817
597 K6X 0.8817
598 GYE 0.8817
599 KJ5 0.8817
600 BA5 0.8816
601 AM1 0.8815
602 AMG 0.8813
603 1XN 0.8812
604 GRE 0.8812
605 ICT 0.8811
606 FA6 0.8811
607 G3E 0.8811
608 AX3 0.8811
609 GDL 0.8810
610 EYK 0.8810
611 FA3 0.8810
612 1U1 0.8810
613 ENL 0.8808
614 1FF 0.8808
615 878 0.8807
616 MYJ 0.8807
617 CCV 0.8807
618 GAF 0.8806
619 IHB 0.8805
620 9TW 0.8804
621 DFB 0.8804
622 PH2 0.8803
623 P3K 0.8802
624 3J8 0.8802
625 GI3 0.8802
626 V1T 0.8800
627 F2W 0.8798
628 FBU 0.8797
629 CTL 0.8796
630 L21 0.8796
631 B5D 0.8795
632 93K 0.8794
633 F3B 0.8794
634 KTW 0.8794
635 CHB 0.8794
636 AHR 0.8792
637 KBB 0.8792
638 6LW 0.8792
639 M6Z 0.8791
640 PCI 0.8791
641 GXL 0.8788
642 15N 0.8788
643 SWD 0.8787
644 4A3 0.8786
645 28S 0.8785
646 DMJ 0.8785
647 YIO 0.8785
648 FHB 0.8785
649 J5I 0.8785
650 1Z8 0.8784
651 1X8 0.8784
652 MWP 0.8783
653 9FE 0.8783
654 DBX 0.8783
655 IPD 0.8782
656 XYP 0.8782
657 505 0.8782
658 INO 0.8781
659 MQB 0.8781
660 KJH 0.8780
661 3HM 0.8779
662 6M1 0.8778
663 SG2 0.8777
664 W81 0.8776
665 23A 0.8776
666 9UL 0.8774
667 MM1 0.8774
668 S76 0.8772
669 TAG 0.8771
670 ADE 0.8771
671 CKA 0.8771
672 MM2 0.8771
673 3PF 0.8771
674 2HO 0.8771
675 0JD 0.8771
676 3AL 0.8768
677 BPS 0.8767
678 A1Y 0.8767
679 KDO 0.8766
680 NNO 0.8765
681 52C 0.8764
682 NQM 0.8763
683 ZZZ 0.8762
684 JLZ 0.8761
685 M1Z 0.8760
686 HHR 0.8759
687 NPA 0.8759
688 D48 0.8757
689 JXN 0.8756
690 2K8 0.8753
691 6MP 0.8752
692 C8O 0.8752
693 55D 0.8749
694 3NY 0.8748
695 2A7 0.8747
696 FA0 0.8747
697 N2Z 0.8746
698 SBI 0.8746
699 F69 0.8745
700 ES4 0.8743
701 DMD 0.8743
702 6F0 0.8743
703 BTE 0.8742
704 0F9 0.8740
705 25W 0.8740
706 H05 0.8740
707 0HO 0.8739
708 PM6 0.8736
709 2ZM 0.8736
710 5QY 0.8735
711 B4O 0.8734
712 7D2 0.8734
713 7HP 0.8734
714 JF2 0.8733
715 1P7 0.8731
716 GJP 0.8731
717 FRU 0.8731
718 BP1 0.8730
719 AS3 0.8730
720 67N 0.8729
721 463 0.8729
722 3Z7 0.8728
723 HH5 0.8728
724 JF1 0.8726
725 I3C 0.8726
726 DPT 0.8721
727 QNA 0.8721
728 68A 0.8720
729 QWW 0.8718
730 0HN 0.8718
731 F5B 0.8718
732 KKN 0.8715
733 3A9 0.8714
734 BHA 0.8714
735 B56 0.8714
736 QWN 0.8712
737 5CU 0.8712
738 Q77 0.8711
739 HPA 0.8711
740 BPY 0.8711
741 G6D 0.8709
742 6OT 0.8707
743 HHS 0.8705
744 2ZV 0.8703
745 OCH 0.8703
746 COU 0.8703
747 B53 0.8703
748 8ZE 0.8702
749 9FL 0.8702
750 9DA 0.8702
751 MMA 0.8701
752 MJ2 0.8701
753 OXZ 0.8700
754 BZ3 0.8700
755 KJU 0.8696
756 GF4 0.8696
757 4RU 0.8696
758 MFU 0.8696
759 1HN 0.8695
760 I7A 0.8695
761 5NU 0.8694
762 XQ0 0.8694
763 FBT 0.8694
764 0GY 0.8693
765 6M4 0.8691
766 27B 0.8691
767 6RQ 0.8691
768 M1A 0.8691
769 DQA 0.8689
770 QZ8 0.8689
771 4M0 0.8686
772 I59 0.8685
773 GCO 0.8685
774 E1K 0.8684
775 86J 0.8680
776 BCP 0.8680
777 LT2 0.8680
778 03V 0.8679
779 H42 0.8679
780 AA 0.8679
781 JXZ 0.8679
782 2HU 0.8678
783 9ZE 0.8677
784 E1T 0.8677
785 96R 0.8677
786 0RN 0.8676
787 9HX 0.8676
788 GLY PRO 0.8675
789 NIG 0.8672
790 2CG 0.8671
791 EQT 0.8671
792 4VS 0.8671
793 ES5 0.8670
794 1IT 0.8669
795 3NT 0.8668
796 SVD 0.8668
797 9CA 0.8667
798 2O6 0.8666
799 ISN 0.8665
800 2AQ 0.8664
801 X8Z 0.8664
802 4FS 0.8663
803 3RK 0.8662
804 20J 0.8662
805 JB5 0.8661
806 LXC 0.8660
807 FUC 0.8660
808 FUL 0.8660
809 I7B 0.8660
810 DOB 0.8659
811 ES7 0.8659
812 6NT 0.8657
813 KED 0.8656
814 5B1 0.8655
815 10L 0.8653
816 P84 0.8653
817 MOK 0.8652
818 ABI 0.8652
819 4CS 0.8652
820 TRP 0.8652
821 261 0.8647
822 OVV 0.8645
823 ZZ3 0.8641
824 5NI 0.8641
825 THA 0.8639
826 SAL 0.8637
827 JTA 0.8637
828 G4D 0.8637
829 MYI 0.8637
830 BQ5 0.8636
831 HHT 0.8634
832 EGR 0.8633
833 SVN 0.8633
834 E35 0.8631
835 BE2 0.8631
836 XXR 0.8631
837 7WA 0.8631
838 QXW 0.8626
839 ANF 0.8626
840 X0V 0.8625
841 N2I 0.8625
842 5GU 0.8621
843 7MX 0.8620
844 F6P 0.8619
845 1XA 0.8618
846 K37 0.8617
847 K44 0.8616
848 7W4 0.8615
849 8XL 0.8615
850 3N4 0.8614
851 173 0.8612
852 JAW 0.8610
853 SLS 0.8606
854 EXD 0.8606
855 HQJ 0.8605
856 RB2 0.8605
857 FP1 0.8605
858 PJW 0.8604
859 ONZ 0.8602
860 SF9 0.8600
861 1F1 0.8597
862 CFA 0.8594
863 3U4 0.8591
864 F81 0.8590
865 ODO 0.8590
866 IFP 0.8589
867 JBE 0.8587
868 4SX 0.8585
869 MM5 0.8581
870 4SV 0.8577
871 3HB 0.8577
872 4ZC 0.8576
873 4FH 0.8572
874 4A1 0.8572
875 NMJ 0.8571
876 JXW 0.8568
877 2HQ 0.8565
878 8G6 0.8562
879 5HN 0.8559
880 L5V 0.8559
881 3XX 0.8558
882 OSB 0.8554
883 BZJ 0.8551
884 FYU 0.8544
885 EKZ 0.8542
886 PZI 0.8536
887 IPB 0.8532
888 5TY 0.8527
889 2F6 0.8525
890 MR1 0.8516
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 6FUL; Ligand: E7Z; Similar sites found with APoc: 2
This union binding pocket(no: 1) in the query (biounit: 6ful.bio1) has 24 residues
No: Leader PDB Ligand Sequence Similarity
1 3OPT AKG 7.23861
2 6IP0 AKG 17.3469
Pocket No.: 2; Query (leader) PDB : 6FUL; Ligand: PG0; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 2) in the query (biounit: 6ful.bio1) has 6 residues
No: Leader PDB Ligand Sequence Similarity
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