Receptor
PDB id Resolution Class Description Source Keywords
3DZL 1.75 Å NON-ENZYME: OTHER CRYSTAL STRUCTURE OF PHZA/B FROM BURKHOLDERIA CEPACIA R18194 COMPLEX WITH (R)-3-OXOCYCLOHEXANECARBOXYLIC ACID BURKHOLDERIA SP. PHENAZINE BIOSYNTHESIS BIOSYNTHETIC PROTEIN
Ref.: PHZA/B CATALYZES THE FORMATION OF THE TRICYCLE IN P BIOSYNTHESIS. J.AM.CHEM.SOC. V. 130 17053 2008
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
3OC A:500;
A:600;
B:500;
B:600;
 Valid;
Valid;
Valid;
Valid;
 none;
none;
none;
none;
 submit data
142.152 C7 H10 O3 C1C[C...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
3JUQ 1.75 Å NON-ENZYME: OTHER CRYSTAL STRUCTURE OF PHZA/B FROM BURKHOLDERIA CEPACIA R18194 COCRYSTALLIZED WITH 2 MM RACEMIC 5-BROMO-2-(PIPERIDIN-3-YLAB ENZOIC ACID BURKHOLDERIA SP. CHIRALITY DRUG DESIGN PHENAZINE BIOSYNTHESIS RACEMATE RAMIXTURE BIOSYNTHETIC PROTEIN
Ref.: THE ACTIVE SITE OF AN ENZYME CAN HOST BOTH ENANTIOM RACEMIC LIGAND SIMULTANEOUSLY ANGEW.CHEM.INT.ED.ENGL. V. 48 9084 2009
Members (8)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1610 families.
1 3CNM - HHA C7 H9 N O3 C1=C[C@@H]....
2 3JUQ Kd = 8.55 uM AJD C12 H15 Br N2 O2 c1cc(c(cc1....
3 3DZL - 3OC C7 H10 O3 C1C[C@H](C....
4 3JUN Kd = 8.55 uM AJD C12 H15 Br N2 O2 c1cc(c(cc1....
5 3JUM - AOD C14 H16 Br N O4 c1cc(c(cc1....
6 3JUO Kd = 8.55 uM AJD C12 H15 Br N2 O2 c1cc(c(cc1....
7 3B4P Kd = 4 uM 3B4 C13 H17 N O2 c1ccc(c(c1....
8 3JUP Kd = 2.63 uM AKD C12 H14 Br N2 O2 c1cc(c(cc1....
70% Homology Family (8)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1331 families.
1 3CNM - HHA C7 H9 N O3 C1=C[C@@H]....
2 3JUQ Kd = 8.55 uM AJD C12 H15 Br N2 O2 c1cc(c(cc1....
3 3DZL - 3OC C7 H10 O3 C1C[C@H](C....
4 3JUN Kd = 8.55 uM AJD C12 H15 Br N2 O2 c1cc(c(cc1....
5 3JUM - AOD C14 H16 Br N O4 c1cc(c(cc1....
6 3JUO Kd = 8.55 uM AJD C12 H15 Br N2 O2 c1cc(c(cc1....
7 3B4P Kd = 4 uM 3B4 C13 H17 N O2 c1ccc(c(c1....
8 3JUP Kd = 2.63 uM AKD C12 H14 Br N2 O2 c1cc(c(cc1....
50% Homology Family (8)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1144 families.
1 3CNM - HHA C7 H9 N O3 C1=C[C@@H]....
2 3JUQ Kd = 8.55 uM AJD C12 H15 Br N2 O2 c1cc(c(cc1....
3 3DZL - 3OC C7 H10 O3 C1C[C@H](C....
4 3JUN Kd = 8.55 uM AJD C12 H15 Br N2 O2 c1cc(c(cc1....
5 3JUM - AOD C14 H16 Br N O4 c1cc(c(cc1....
6 3JUO Kd = 8.55 uM AJD C12 H15 Br N2 O2 c1cc(c(cc1....
7 3B4P Kd = 4 uM 3B4 C13 H17 N O2 c1ccc(c(c1....
8 3JUP Kd = 2.63 uM AKD C12 H14 Br N2 O2 c1cc(c(cc1....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: 3OC; Similar ligands found: 3
No: Ligand ECFP6 Tc MDL keys Tc
1 3OC 1 1
2 IQ0 0.448276 0.666667
3 KTA 0.439024 0.818182
Similar Ligands (3D)
Ligand no: 1; Ligand: 3OC; Similar ligands found: 1300
No: Ligand Similarity coefficient
1 3HB 1.0000
2 53C 1.0000
3 GAB 0.9982
4 3NT 0.9970
5 OVV 0.9892
6 WCE 0.9834
7 3AB 0.9822
8 5HN 0.9803
9 4CS 0.9802
10 BEZ 0.9783
11 NMJ 0.9778
12 BEN 0.9774
13 6PC 0.9768
14 8GC 0.9742
15 3BZ 0.9740
16 BAM 0.9736
17 AC0 0.9721
18 DBH 0.9720
19 GTQ 0.9698
20 51R 0.9690
21 MLT 0.9690
22 ORO 0.9686
23 J9T 0.9684
24 NCA 0.9678
25 5RG 0.9677
26 069 0.9671
27 YCP 0.9665
28 TMH 0.9664
29 3HA 0.9662
30 1P3 0.9660
31 NBZ 0.9660
32 NIO 0.9654
33 UNU 0.9654
34 PZA 0.9652
35 DHB 0.9650
36 4NC 0.9650
37 M58 0.9646
38 45L 0.9644
39 OAA 0.9643
40 PBC 0.9637
41 3M0 0.9631
42 54G 0.9630
43 D1X 0.9627
44 DOR 0.9620
45 34D 0.9599
46 SAL 0.9594
47 5M0 0.9589
48 BRT 0.9584
49 MUC 0.9584
50 QSC 0.9581
51 MYJ 0.9579
52 3F0 0.9576
53 F05 0.9576
54 P9P 0.9575
55 7MU 0.9572
56 SJ5 0.9572
57 INO 0.9571
58 JFJ 0.9564
59 PCA 0.9562
60 FBW 0.9556
61 3MB 0.9547
62 9TZ 0.9546
63 5HY 0.9545
64 XCZ 0.9543
65 VNJ 0.9541
66 SS1 0.9532
67 C2A 0.9531
68 7WG 0.9530
69 BNS 0.9527
70 DHS 0.9523
71 OXC 0.9523
72 2HO 0.9522
73 OVM 0.9522
74 ISZ 0.9521
75 CXF 0.9518
76 SX1 0.9511
77 9TW 0.9508
78 XX2 0.9506
79 SHA 0.9504
80 FE DB1 0.9499
81 BHO 0.9499
82 RSO 0.9499
83 2AL 0.9495
84 CFI 0.9494
85 MRZ 0.9494
86 NPO 0.9493
87 QSB 0.9492
88 KOJ 0.9488
89 TEO 0.9486
90 NTN 0.9485
91 SS2 0.9483
92 BZX 0.9483
93 PHB 0.9481
94 DYA 0.9476
95 VNL 0.9472
96 6CS 0.9471
97 I3A 0.9467
98 1Y6 0.9458
99 F31 0.9456
100 TLA 0.9456
101 DHK 0.9454
102 JKE 0.9452
103 JBK 0.9450
104 PZI 0.9449
105 CHB 0.9449
106 EUG 0.9447
107 VGL 0.9446
108 2K4 0.9444
109 HPA 0.9444
110 HHA 0.9443
111 5OB 0.9443
112 X0V 0.9438
113 BE2 0.9436
114 93K 0.9435
115 IFP 0.9434
116 BE7 0.9432
117 5MK 0.9432
118 XAN 0.9432
119 6AI 0.9431
120 FEH 0.9431
121 LMR 0.9430
122 14O 0.9427
123 7N0 0.9425
124 FAN 0.9421
125 NIZ 0.9419
126 GLU 0.9418
127 I1E 0.9416
128 5H1 0.9416
129 F60 0.9414
130 14J 0.9411
131 LNR 0.9408
132 KBB 0.9403
133 Q6T 0.9403
134 7HP 0.9402
135 IHB 0.9400
136 HBD 0.9398
137 NNO 0.9396
138 ASC 0.9396
139 OW4 0.9396
140 FHB 0.9394
141 ZXD 0.9393
142 4A3 0.9392
143 3ID 0.9392
144 TIU 0.9390
145 3AL 0.9389
146 5MI 0.9388
147 4FH 0.9387
148 ES6 0.9385
149 6M4 0.9385
150 4HM 0.9383
151 AW5 0.9382
152 A13 0.9382
153 MNN 0.9381
154 FBM 0.9381
155 5MB 0.9379
156 AMC 0.9379
157 ABV 0.9377
158 DBX 0.9376
159 UYA 0.9374
160 F9P 0.9374
161 PMB 0.9373
162 Q88 0.9372
163 V55 0.9372
164 GUN 0.9371
165 AX7 0.9370
166 3U4 0.9369
167 FA1 0.9367
168 1DJ 0.9367
169 3HM 0.9366
170 EKZ 0.9365
171 TH7 0.9365
172 L99 0.9363
173 IDM 0.9363
174 OHP 0.9362
175 K5W 0.9361
176 270 0.9359
177 ASP 0.9359
178 6M9 0.9357
179 RM1 0.9354
180 4SV 0.9352
181 BDP 0.9352
182 FB2 0.9350
183 EYK 0.9348
184 SKM 0.9344
185 UGC 0.9343
186 2MI 0.9342
187 JLZ 0.9338
188 4XR 0.9337
189 3FH 0.9337
190 QY9 0.9334
191 4SX 0.9333
192 5RN 0.9333
193 TZE 0.9332
194 11S 0.9331
195 PAC 0.9331
196 ET2 0.9330
197 7WV 0.9328
198 DAS 0.9328
199 SVD 0.9327
200 IFM 0.9325
201 2DR 0.9325
202 3SK 0.9324
203 SMV 0.9324
204 GYE 0.9322
205 23A 0.9321
206 PAB 0.9321
207 1F1 0.9319
208 DMD 0.9318
209 XM0 0.9318
210 9MG 0.9317
211 9DG 0.9316
212 4HC 0.9315
213 GJZ 0.9314
214 5NU 0.9314
215 FP1 0.9310
216 E7Z 0.9310
217 HBX 0.9310
218 5CU 0.9309
219 3IT 0.9308
220 HY1 0.9307
221 OVP 0.9307
222 JYD 0.9306
223 URC 0.9306
224 FBV 0.9306
225 0R0 0.9306
226 AC6 0.9305
227 T9G 0.9304
228 R9S 0.9303
229 OXZ 0.9302
230 ES9 0.9302
231 ES2 0.9300
232 4Z4 0.9300
233 IT2 0.9299
234 FYU 0.9299
235 SYN 0.9298
236 SPA 0.9296
237 1DW 0.9294
238 FQI 0.9294
239 IND 0.9293
240 PIY 0.9292
241 PEL 0.9291
242 TAR 0.9291
243 PBZ 0.9290
244 M4T 0.9290
245 40E 0.9290
246 5NI 0.9289
247 RNT 0.9288
248 ZZ3 0.9287
249 FA0 0.9286
250 FGZ 0.9286
251 DOB 0.9285
252 VGD 0.9284
253 S76 0.9283
254 URS 0.9283
255 PHU 0.9281
256 IP0 0.9281
257 COU 0.9280
258 FOT 0.9280
259 1P8 0.9279
260 DFB 0.9279
261 J9W 0.9278
262 IJZ 0.9277
263 UY7 0.9276
264 P92 0.9276
265 URP 0.9276
266 TPA 0.9275
267 LZ1 0.9275
268 AL0 0.9275
269 H4N 0.9272
270 LDP 0.9271
271 PYF 0.9271
272 271 0.9269
273 JZ7 0.9267
274 ABN 0.9267
275 BHA 0.9267
276 ITN 0.9266
277 4M4 0.9266
278 PRO 0.9265
279 SVN 0.9265
280 GAG 0.9265
281 CRN 0.9262
282 Z82 0.9262
283 P72 0.9261
284 GDE 0.9260
285 AZF 0.9260
286 AHR 0.9260
287 ASN 0.9259
288 HMU 0.9259
289 QUZ 0.9258
290 2CK 0.9258
291 36R 0.9257
292 PEA 0.9256
293 7VS 0.9256
294 9EW 0.9255
295 FBU 0.9255
296 M0Q 0.9255
297 SRT 0.9252
298 FK1 0.9252
299 CN0 0.9252
300 CLW 0.9252
301 ADE 0.9251
302 0RW 0.9248
303 AKH 0.9248
304 FPI 0.9247
305 4M0 0.9246
306 BZI 0.9245
307 GBD 0.9244
308 1LN 0.9243
309 HXX 0.9243
310 ES0 0.9242
311 282 0.9241
312 P3K 0.9240
313 8EZ 0.9240
314 JZ5 0.9240
315 G3P 0.9239
316 G3H 0.9239
317 0R1 0.9239
318 C2U 0.9239
319 PRS 0.9238
320 EA1 0.9237
321 R8S 0.9235
322 PDC 0.9233
323 FB1 0.9232
324 MPI 0.9232
325 BZ3 0.9232
326 LT2 0.9232
327 1DV 0.9231
328 0P6 0.9230
329 XQ0 0.9229
330 CWM 0.9228
331 2LP 0.9227
332 N5J 0.9227
333 717 0.9227
334 8NY 0.9227
335 NBE 0.9225
336 4NG 0.9225
337 MJ2 0.9225
338 EV0 0.9224
339 TFB 0.9223
340 2F6 0.9222
341 JA8 0.9222
342 2TQ 0.9222
343 2ZM 0.9221
344 RSF 0.9221
345 URQ 0.9220
346 4MA 0.9220
347 TZC 0.9220
348 DEN 0.9219
349 2AQ 0.9219
350 NPY 0.9218
351 4JT 0.9218
352 M1Q 0.9217
353 HH5 0.9217
354 A29 0.9216
355 IPB 0.9216
356 LNO 0.9215
357 ISD 0.9214
358 3XX 0.9214
359 HMH 0.9214
360 42C 0.9213
361 H42 0.9213
362 24W 0.9212
363 PY7 0.9211
364 OCH 0.9210
365 2PC 0.9210
366 7NI 0.9209
367 HIO 0.9209
368 PIM 0.9207
369 ICO 0.9206
370 AZA 0.9203
371 FCR 0.9203
372 BZF 0.9201
373 5XC 0.9201
374 NXA 0.9201
375 1WD 0.9201
376 MZW 0.9201
377 03V 0.9200
378 4JP 0.9199
379 UFV 0.9197
380 SEP 0.9196
381 AS3 0.9196
382 DIU 0.9196
383 N7P 0.9196
384 F81 0.9195
385 5SG 0.9193
386 OEM 0.9193
387 HGQ 0.9192
388 FBB 0.9191
389 1NP 0.9190
390 ABI 0.9190
391 HJP 0.9189
392 OK7 0.9189
393 GVH 0.9189
394 7A8 0.9188
395 ES5 0.9188
396 5IQ 0.9186
397 BSX 0.9186
398 T2C 0.9185
399 2PG 0.9185
400 RNS 0.9184
401 RIB 0.9184
402 L3Q 0.9184
403 JB5 0.9183
404 MR1 0.9183
405 GIF 0.9181
406 10L 0.9181
407 4FS 0.9181
408 9X7 0.9181
409 RMN 0.9181
410 CFP 0.9179
411 GRE 0.9179
412 JBH 0.9177
413 HBA 0.9176
414 MXN 0.9176
415 XLS 0.9175
416 826 0.9175
417 CRS 0.9175
418 6TZ 0.9172
419 1P7 0.9172
420 NK 0.9171
421 AGK 0.9170
422 52C 0.9170
423 4P5 0.9170
424 0HN 0.9169
425 N2Z 0.9169
426 HQJ 0.9169
427 QSH 0.9168
428 HY3 0.9166
429 C21 0.9166
430 9CL 0.9166
431 OXQ 0.9166
432 URA 0.9166
433 HZP 0.9164
434 5JQ 0.9164
435 HX3 0.9163
436 3DO 0.9161
437 9DA 0.9161
438 9HX 0.9160
439 ASO 0.9160
440 FBJ 0.9159
441 JBN 0.9159
442 JPZ 0.9158
443 141 0.9158
444 QDK 0.9158
445 3PF 0.9158
446 0HO 0.9157
447 97T 0.9156
448 K2T 0.9156
449 IOM 0.9155
450 4YS 0.9154
451 EDR 0.9154
452 2RH 0.9154
453 6MP 0.9154
454 F0J 0.9153
455 IGA 0.9153
456 0F9 0.9152
457 6F0 0.9152
458 O7U 0.9152
459 1PT 0.9152
460 8TX 0.9151
461 JZ9 0.9151
462 8H8 0.9151
463 98J 0.9150
464 AZG 0.9150
465 4ME 0.9150
466 3NY 0.9150
467 K34 0.9150
468 2A7 0.9149
469 H7Y 0.9149
470 BTY 0.9149
471 URF 0.9149
472 SMN 0.9148
473 BGC 0.9148
474 7WA 0.9147
475 PKU 0.9147
476 BP1 0.9145
477 2D0 0.9145
478 APY 0.9145
479 261 0.9145
480 5Q0 0.9144
481 PYJ 0.9144
482 4RW 0.9143
483 1LM 0.9143
484 60P 0.9143
485 173 0.9141
486 PEP 0.9141
487 PRZ 0.9140
488 7B4 0.9140
489 1MR 0.9139
490 QBK 0.9139
491 PYC 0.9139
492 CEE 0.9138
493 HL5 0.9138
494 UNC 0.9136
495 ADZ 0.9136
496 XAZ 0.9136
497 M1H 0.9136
498 7HQ 0.9135
499 6M1 0.9135
500 1SQ 0.9135
501 1LQ 0.9134
502 ES1 0.9133
503 H76 0.9133
504 HQY 0.9132
505 75K 0.9132
506 2A9 0.9132
507 YH7 0.9131
508 67N 0.9130
509 54D 0.9129
510 5VM 0.9129
511 26D 0.9129
512 2XX 0.9128
513 0CT 0.9128
514 92K 0.9128
515 EOL 0.9127
516 BCU 0.9127
517 CTS 0.9125
518 XBT 0.9125
519 XUL 0.9125
520 DIN 0.9123
521 2HU 0.9123
522 DA4 0.9122
523 69O 0.9122
524 QIC 0.9121
525 SC2 0.9121
526 M1A 0.9120
527 JZ3 0.9120
528 3Z7 0.9120
529 LEU 0.9119
530 TP5 0.9119
531 3A9 0.9118
532 4AA 0.9117
533 42J 0.9115
534 6GU 0.9115
535 FUM 0.9115
536 QWN 0.9114
537 NOY 0.9114
538 R20 0.9114
539 RAT 0.9113
540 M2K 0.9113
541 6NT 0.9112
542 B55 0.9112
543 9RW 0.9110
544 GTR 0.9110
545 AKG 0.9110
546 3SL 0.9109
547 HDH 0.9108
548 265 0.9108
549 4WL 0.9108
550 COI 0.9107
551 A2F 0.9107
552 ADA 0.9106
553 G4D 0.9106
554 9X6 0.9106
555 4ZC 0.9105
556 G5V 0.9104
557 I4B 0.9102
558 AZ8 0.9101
559 GLC 0.9101
560 SIN 0.9101
561 A7W 0.9100
562 5QY 0.9099
563 SD4 0.9099
564 TSU 0.9098
565 174 0.9098
566 PM6 0.9096
567 XIY 0.9096
568 5B1 0.9096
569 OMD 0.9095
570 ODO 0.9094
571 2LY 0.9094
572 47J 0.9093
573 ONR 0.9093
574 B24 0.9092
575 3PG 0.9092
576 BTE 0.9091
577 23W 0.9091
578 3Z8 0.9091
579 6AP 0.9090
580 MWP 0.9089
581 MRW 0.9089
582 3DM 0.9089
583 3YP 0.9088
584 RUU 0.9088
585 290 0.9087
586 JZ4 0.9087
587 GLY GLY 0.9087
588 24B 0.9087
589 3V4 0.9087
590 X09 0.9086
591 LCN 0.9085
592 PRY 0.9085
593 GCU 0.9085
594 5AC 0.9085
595 6JN 0.9084
596 51F 0.9084
597 263 0.9084
598 SW7 0.9083
599 IFL 0.9083
600 FBA 0.9081
601 273 0.9081
602 1GP 0.9080
603 SAF 0.9079
604 NOJ 0.9079
605 G2F 0.9079
606 LYL 0.9078
607 5XB 0.9078
608 IHG 0.9078
609 WBU 0.9078
610 6OT 0.9076
611 4VP 0.9076
612 MS9 0.9076
613 SYG 0.9076
614 5JL 0.9074
615 OHG 0.9073
616 5WV 0.9073
617 Z6J 0.9069
618 KT7 0.9068
619 1SA 0.9067
620 XYL 0.9065
621 RB5 0.9065
622 286 0.9065
623 XX3 0.9064
624 SAN 0.9063
625 264 0.9063
626 JAE 0.9062
627 ICF 0.9062
628 DGJ 0.9061
629 DIE 0.9061
630 M3H 0.9060
631 HPS 0.9060
632 M2H 0.9060
633 JZ1 0.9060
634 HLR 0.9059
635 QXW 0.9058
636 M5K 0.9057
637 AEH 0.9056
638 ILE 0.9056
639 R8V 0.9056
640 XYP 0.9056
641 ROR 0.9055
642 O2A 0.9055
643 Q24 0.9055
644 DE5 0.9055
645 CTL 0.9055
646 3HP 0.9054
647 DX4 0.9054
648 6NI 0.9054
649 6RQ 0.9054
650 2BG 0.9054
651 ARW 0.9054
652 FBS 0.9053
653 92P 0.9052
654 ZZT 0.9052
655 NCT 0.9051
656 GCB 0.9051
657 2CO 0.9051
658 ES4 0.9050
659 KKN 0.9050
660 4ZA 0.9050
661 MLE 0.9050
662 PD2 0.9049
663 B2J 0.9047
664 NFQ 0.9047
665 8G0 0.9046
666 HH8 0.9043
667 DS0 0.9043
668 PGH 0.9043
669 AJ2 0.9043
670 4XH 0.9042
671 M6N 0.9042
672 KPL 0.9042
673 PE0 0.9041
674 AQO 0.9041
675 TRA 0.9041
676 QX4 0.9041
677 GXL 0.9039
678 1M2 0.9039
679 F9Y 0.9039
680 HSE 0.9039
681 B62 0.9038
682 TZL 0.9037
683 ZBT 0.9037
684 1XM 0.9037
685 23J 0.9037
686 13P 0.9036
687 1DU 0.9035
688 DHI 0.9034
689 DUC 0.9034
690 XXG 0.9033
691 SHF 0.9033
692 4CL 0.9032
693 GLN 0.9029
694 TDR 0.9028
695 VXX 0.9028
696 BP9 0.9028
697 34V 0.9028
698 8OZ 0.9026
699 ES7 0.9026
700 JAW 0.9026
701 2YU 0.9025
702 284 0.9025
703 4ZE 0.9024
704 S2G 0.9022
705 Z5P 0.9022
706 C2Y 0.9021
707 1AB 0.9020
708 FUB 0.9020
709 GZ3 0.9019
710 MEW 0.9019
711 ISN 0.9017
712 3WA 0.9017
713 MNM 0.9016
714 G3E 0.9016
715 6LW 0.9015
716 DHY 0.9015
717 DQA 0.9014
718 JBE 0.9014
719 ONL 0.9014
720 EDG 0.9013
721 SWA 0.9013
722 IF7 0.9011
723 4J8 0.9011
724 2AS 0.9011
725 OGA 0.9010
726 8EW 0.9010
727 WOT 0.9010
728 NYL 0.9009
729 R8A 0.9009
730 DBJ 0.9008
731 ZGL 0.9007
732 8IG 0.9007
733 4XV 0.9006
734 KJY 0.9006
735 RHU 0.9005
736 4JQ 0.9005
737 KMH 0.9004
738 PEZ 0.9000
739 1AL 0.8999
740 RJY 0.8999
741 2CQ 0.8999
742 HQ9 0.8998
743 3HG 0.8998
744 0W8 0.8998
745 L5V 0.8998
746 FA3 0.8997
747 4P0 0.8996
748 82I 0.8996
749 MWM 0.8996
750 GAL 0.8995
751 RCO 0.8995
752 DPR 0.8995
753 AAS 0.8992
754 BOA 0.8992
755 AMS 0.8992
756 GUA 0.8992
757 INE 0.8991
758 RBL 0.8990
759 JB8 0.8988
760 HSM 0.8987
761 0CU 0.8986
762 NSP 0.8986
763 FOA 0.8986
764 GLY ALA 0.8985
765 N3W 0.8985
766 3R6 0.8984
767 OW7 0.8984
768 5GU 0.8983
769 LDU 0.8981
770 EHM 0.8981
771 M6W 0.8980
772 AHB 0.8980
773 64K 0.8980
774 J9Q 0.8979
775 LZM 0.8977
776 JDN 0.8976
777 GZL 0.8976
778 BCP 0.8975
779 KUF 0.8975
780 SPV 0.8974
781 R2B 0.8973
782 EVA 0.8972
783 1MC 0.8972
784 QMP 0.8971
785 SE2 0.8971
786 PYG 0.8971
787 XSP 0.8970
788 329 0.8970
789 150 0.8970
790 PEQ 0.8969
791 0V5 0.8969
792 2HG 0.8969
793 XBZ 0.8969
794 A1U 0.8969
795 KYD 0.8969
796 THE 0.8968
797 GP9 0.8968
798 HPY 0.8968
799 42A 0.8967
800 HYP 0.8966
801 H8N 0.8966
802 8K2 0.8964
803 ALL 0.8964
804 4JJ 0.8964
805 GLY PRO 0.8964
806 1WG 0.8964
807 HT4 0.8963
808 OTR 0.8962
809 258 0.8962
810 PGA 0.8962
811 FRU 0.8961
812 TSS 0.8960
813 XYD 0.8960
814 CWJ 0.8960
815 M1E 0.8959
816 J5I 0.8959
817 5UC 0.8959
818 152 0.8959
819 1XN 0.8958
820 4XS 0.8958
821 MCT 0.8958
822 FBT 0.8958
823 7W4 0.8955
824 2FY 0.8955
825 8WT 0.8955
826 2FG 0.8955
827 DTL 0.8955
828 2MP 0.8954
829 PYD 0.8953
830 ICP 0.8953
831 IDH 0.8952
832 2HQ 0.8952
833 MAE 0.8951
834 34A 0.8950
835 AEF 0.8949
836 JZ2 0.8949
837 TTL 0.8949
838 PPR 0.8947
839 D48 0.8947
840 G2H 0.8946
841 BMA 0.8946
842 XQG 0.8946
843 4HO 0.8945
844 2AC 0.8943
845 TH0 0.8943
846 PRI 0.8943
847 293 0.8941
848 MUA 0.8941
849 VOH 0.8940
850 44V 0.8940
851 RIP 0.8940
852 XYS 0.8940
853 GIV 0.8939
854 32O 0.8939
855 86J 0.8939
856 KJU 0.8938
857 LKA 0.8938
858 N2I 0.8938
859 TAG 0.8936
860 GRO 0.8936
861 BR9 0.8936
862 WOO 0.8934
863 XRG 0.8933
864 4JM 0.8933
865 HSO 0.8933
866 4H2 0.8932
867 275 0.8932
868 M4E 0.8932
869 AHN 0.8932
870 27Y 0.8932
871 4JL 0.8929
872 CMS 0.8929
873 7ZE 0.8929
874 4YO 0.8929
875 C2B 0.8928
876 6UA 0.8928
877 463 0.8927
878 8S0 0.8927
879 5RO 0.8927
880 JND 0.8926
881 HIS 0.8923
882 32X 0.8923
883 5QX 0.8922
884 TM7 0.8919
885 G3F 0.8919
886 PRA 0.8917
887 IV2 0.8917
888 8WO 0.8916
889 MEV 0.8915
890 SR1 0.8915
891 LG3 0.8912
892 DHR 0.8912
893 PBA 0.8912
894 9TY 0.8912
895 AOS 0.8910
896 CWS 0.8910
897 LSA 0.8909
898 9YL 0.8908
899 B3R 0.8907
900 ARB 0.8907
901 1DQ 0.8906
902 TYL 0.8905
903 GLA 0.8904
904 A09 0.8903
905 SYV 0.8903
906 HLZ 0.8901
907 AX3 0.8900
908 XXP 0.8900
909 LGC 0.8900
910 HX2 0.8900
911 DMJ 0.8899
912 9FL 0.8899
913 ORN 0.8898
914 7W1 0.8896
915 II6 0.8895
916 F12 0.8895
917 JIF 0.8894
918 GAF 0.8894
919 K7M 0.8893
920 43M 0.8893
921 SNE 0.8893
922 0LH 0.8892
923 AZ9 0.8892
924 2ZV 0.8891
925 FPY 0.8889
926 CYT 0.8889
927 149 0.8888
928 LLQ 0.8888
929 2EC 0.8887
930 HDA 0.8887
931 B53 0.8886
932 8CM 0.8884
933 LG5 0.8884
934 JTH 0.8884
935 449 0.8883
936 TEP 0.8883
937 0MK 0.8881
938 2H5 0.8880
939 4SD 0.8880
940 B57 0.8880
941 25W 0.8878
942 GVG 0.8877
943 MAJ 0.8876
944 FUL 0.8874
945 GCS 0.8873
946 MZB 0.8870
947 DNF 0.8869
948 4NM 0.8869
949 4FA 0.8868
950 FDK 0.8867
951 KBG 0.8867
952 7WR 0.8867
953 5JC 0.8865
954 RP7 0.8865
955 X6X 0.8863
956 CIZ 0.8863
957 J1Z 0.8863
958 GOO 0.8862
959 TTY 0.8862
960 2IT 0.8861
961 3CH 0.8860
962 AFR 0.8860
963 8ZE 0.8860
964 PFL 0.8860
965 SOE 0.8859
966 GLT 0.8858
967 YRL 0.8857
968 GV9 0.8857
969 5WY 0.8856
970 RBJ 0.8856
971 AC5 0.8855
972 DRL 0.8854
973 SYM 0.8854
974 M1Z 0.8854
975 AN0 0.8853
976 KDG 0.8853
977 MBG 0.8852
978 BVF 0.8852
979 HQT 0.8852
980 0N7 0.8852
981 4JO 0.8852
982 QPR 0.8852
983 9R5 0.8851
984 12Q 0.8851
985 HCS 0.8851
986 BNF 0.8850
987 FLC 0.8850
988 E5X 0.8850
989 BEA 0.8849
990 NLE 0.8849
991 IPZ 0.8848
992 TT4 0.8848
993 SOR 0.8846
994 VAH 0.8845
995 5MH 0.8844
996 BHH 0.8843
997 280 0.8843
998 PSJ 0.8842
999 DEE 0.8842
1000 MAN 0.8841
1001 OTD 0.8841
1002 6FZ 0.8841
1003 M3T 0.8840
1004 PXL 0.8840
1005 3BU 0.8840
1006 4TU 0.8840
1007 CIG 0.8840
1008 SYC 0.8838
1009 45C 0.8838
1010 BR8 0.8837
1011 2ZQ 0.8836
1012 DGL 0.8836
1013 0FO 0.8835
1014 BDF 0.8833
1015 95Z 0.8833
1016 YIO 0.8831
1017 M0W 0.8831
1018 HEW 0.8830
1019 HA5 0.8830
1020 KJH 0.8827
1021 1GN 0.8826
1022 R67 0.8822
1023 GIO 0.8822
1024 IUR 0.8822
1025 PHE 0.8822
1026 GLY CYS 0.8821
1027 12M 0.8820
1028 PZM 0.8820
1029 SF6 0.8819
1030 E35 0.8819
1031 TC7 0.8819
1032 T6C 0.8819
1033 B40 0.8818
1034 LRH 0.8817
1035 9ON 0.8817
1036 8GF 0.8816
1037 MRY 0.8816
1038 AH8 0.8816
1039 IMR 0.8815
1040 4MU 0.8815
1041 HQD 0.8814
1042 MET 0.8814
1043 15L 0.8811
1044 ICC 0.8810
1045 DAL DAL 0.8810
1046 94W 0.8810
1047 D07 0.8810
1048 SHG 0.8809
1049 LXC 0.8809
1050 KFH 0.8809
1051 DIG 0.8808
1052 IZC 0.8808
1053 DFU 0.8807
1054 SKA 0.8806
1055 Q02 0.8804
1056 PAF 0.8804
1057 ANN 0.8804
1058 DHQ 0.8803
1059 ABE 0.8802
1060 ERH 0.8802
1061 FUC 0.8801
1062 CIT 0.8800
1063 AUD 0.8799
1064 13X 0.8797
1065 0JD 0.8797
1066 SDD 0.8796
1067 B85 0.8796
1068 5WX 0.8796
1069 0TR 0.8795
1070 F4Z 0.8795
1071 MWJ 0.8794
1072 3QM 0.8793
1073 9PY 0.8793
1074 KDF 0.8793
1075 TRC 0.8792
1076 GXY 0.8792
1077 ARA 0.8792
1078 LER 0.8791
1079 XDE 0.8791
1080 MEQ 0.8791
1081 AX2 0.8789
1082 HC4 0.8789
1083 495 0.8788
1084 SF9 0.8788
1085 R1X 0.8786
1086 3RK 0.8786
1087 0TU 0.8785
1088 NVU 0.8784
1089 PBE 0.8784
1090 TWO 0.8784
1091 GLF 0.8783
1092 PNZ 0.8783
1093 2CL 0.8782
1094 HHQ 0.8780
1095 MZG 0.8780
1096 PA1 0.8778
1097 MQN 0.8778
1098 BZ2 0.8778
1099 ESP 0.8777
1100 HDL 0.8776
1101 4MV 0.8776
1102 2ZX 0.8775
1103 44W 0.8775
1104 BVC 0.8774
1105 JXN 0.8774
1106 GLO 0.8772
1107 NCD 0.8772
1108 MLA 0.8772
1109 7UC 0.8771
1110 GLL 0.8771
1111 APZ 0.8768
1112 5ZE 0.8765
1113 KIV 0.8764
1114 NDH 0.8763
1115 2EH 0.8763
1116 2FT 0.8761
1117 ECE 0.8760
1118 R9Y 0.8760
1119 0GZ 0.8759
1120 O72 0.8758
1121 285 0.8756
1122 H3M 0.8756
1123 FCB 0.8755
1124 MAK 0.8755
1125 OSE 0.8752
1126 Y8I 0.8752
1127 PQK 0.8752
1128 PMF 0.8751
1129 1XA 0.8751
1130 RM4 0.8750
1131 MFU 0.8750
1132 N4B 0.8748
1133 RUY 0.8748
1134 F5B 0.8748
1135 KVP 0.8747
1136 FUF 0.8745
1137 KIB 0.8745
1138 35C 0.8744
1139 5AN 0.8744
1140 3C4 0.8744
1141 3AY 0.8741
1142 NGO 0.8739
1143 NMG 0.8739
1144 APG 0.8739
1145 DQU 0.8739
1146 QUS 0.8738
1147 FDB 0.8738
1148 2AK 0.8738
1149 7MH 0.8737
1150 GMN 0.8734
1151 MVN 0.8733
1152 36Y 0.8732
1153 RD4 0.8731
1154 6MH 0.8730
1155 3MC 0.8730
1156 XHP 0.8730
1157 SOL 0.8726
1158 LFR 0.8725
1159 3CU 0.8725
1160 HZQ 0.8724
1161 4AV 0.8724
1162 AIN 0.8724
1163 TGX 0.8724
1164 SNU 0.8722
1165 OTW 0.8721
1166 2MY 0.8719
1167 EQT 0.8719
1168 FW5 0.8719
1169 AMH 0.8717
1170 CPZ 0.8717
1171 SYA 0.8716
1172 MSR 0.8716
1173 N6C 0.8716
1174 J6W 0.8715
1175 B60 0.8715
1176 7CZ 0.8713
1177 15N 0.8713
1178 4BZ 0.8712
1179 SRO 0.8711
1180 MSN 0.8711
1181 TLD 0.8709
1182 CAX 0.8709
1183 ACH 0.8708
1184 QX2 0.8707
1185 41K 0.8707
1186 9FE 0.8704
1187 SXS 0.8703
1188 3CE 0.8702
1189 VK3 0.8701
1190 PLU 0.8700
1191 M45 0.8700
1192 QWW 0.8698
1193 AT3 0.8698
1194 HVQ 0.8695
1195 FUD 0.8695
1196 HHH 0.8694
1197 2C9 0.8694
1198 HLD 0.8694
1199 BNL 0.8693
1200 4JU 0.8693
1201 2CM 0.8692
1202 MLI 0.8692
1203 P84 0.8691
1204 JFD 0.8690
1205 0OC 0.8690
1206 8GK 0.8690
1207 RPQ 0.8687
1208 6ME 0.8687
1209 DUB 0.8685
1210 ICB 0.8685
1211 MBD 0.8684
1212 BDR 0.8684
1213 SIF 0.8683
1214 BPN 0.8683
1215 HCI 0.8680
1216 36E 0.8680
1217 3MG 0.8679
1218 JAB 0.8678
1219 2O6 0.8676
1220 8GL 0.8675
1221 H62 0.8674
1222 KDV 0.8673
1223 MAQ 0.8671
1224 BML 0.8671
1225 EXO 0.8669
1226 IPM 0.8669
1227 IAC 0.8669
1228 9KH 0.8669
1229 NID 0.8665
1230 X05 0.8665
1231 9SE 0.8663
1232 INS 0.8663
1233 3MV 0.8662
1234 PQ0 0.8661
1235 PG0 0.8660
1236 269 0.8659
1237 J9N 0.8659
1238 DII 0.8657
1239 259 0.8655
1240 HAI 0.8655
1241 NVI 0.8650
1242 KIA 0.8649
1243 4HP 0.8648
1244 MFB 0.8645
1245 DTT 0.8645
1246 5DI 0.8644
1247 4A5 0.8644
1248 NEQ 0.8643
1249 PRF 0.8638
1250 C5J 0.8637
1251 DNC 0.8635
1252 4CH 0.8633
1253 278 0.8632
1254 N8Y 0.8632
1255 9YT 0.8632
1256 1WC 0.8627
1257 ZB1 0.8624
1258 EGR 0.8623
1259 HBU 0.8621
1260 TFU 0.8620
1261 15E 0.8620
1262 I2M 0.8618
1263 CEJ 0.8615
1264 X1S 0.8614
1265 PYQ 0.8610
1266 7D2 0.8609
1267 PSV 0.8608
1268 GF4 0.8606
1269 ESX 0.8604
1270 AMG 0.8602
1271 3ZQ 0.8602
1272 NTM 0.8599
1273 7VJ 0.8596
1274 PJW 0.8595
1275 0W1 0.8591
1276 3PY 0.8591
1277 PAH 0.8591
1278 UAN 0.8590
1279 KG7 0.8590
1280 2MH 0.8587
1281 SWD 0.8579
1282 REL 0.8578
1283 DQY 0.8568
1284 CSS 0.8567
1285 BNT 0.8566
1286 B0D 0.8563
1287 PHT 0.8563
1288 VAL 0.8563
1289 ALO 0.8561
1290 D3M 0.8557
1291 MT5 0.8552
1292 TOF 0.8550
1293 DZX 0.8549
1294 TPO 0.8539
1295 PFB 0.8535
1296 N8P 0.8535
1297 SLC 0.8521
1298 8XL 0.8520
1299 7MK 0.8518
1300 JKZ 0.8512
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 3JUQ; Ligand: AKD; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 1) in the query (biounit: 3juq.bio1) has 25 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 3JUQ; Ligand: AJD; 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: 3juq.bio1) has 24 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 3; Query (leader) PDB : 3JUQ; Ligand: AKD; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 3) in the query (biounit: 3juq.bio1) has 25 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 4; Query (leader) PDB : 3JUQ; Ligand: AJD; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 4) in the query (biounit: 3juq.bio1) has 24 residues
No: Leader PDB Ligand Sequence Similarity
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