Receptor
PDB id Resolution Class Description Source Keywords
5KJW 1.9 Å EC: 2.3.1.133 CRYSTAL STRUCTURE OF COLEUS BLUMEI HCT IN COMPLEX WITH 3- HYDROXYACETOPHENONE SOLENOSTEMON SCUTELLARIOIDES PHENYLPROPANOID METABOLISM BAHD HCT ACYLTRANSFERASE TRAN
Ref.: DYNAMIC CONFORMATIONAL STATES DICTATE SELECTIVITY T NATIVE SUBSTRATE IN A SUBSTRATE-PERMISSIVE ACYLTRAN BIOCHEMISTRY V. 55 6314 2016
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
53C A:800;
B:800;
Valid;
Valid;
none;
none;
submit data
136.148 C8 H8 O2 CC(=O...
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90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
5KJW 1.9 Å EC: 2.3.1.133 CRYSTAL STRUCTURE OF COLEUS BLUMEI HCT IN COMPLEX WITH 3- HYDROXYACETOPHENONE SOLENOSTEMON SCUTELLARIOIDES PHENYLPROPANOID METABOLISM BAHD HCT ACYLTRANSFERASE TRAN
Ref.: DYNAMIC CONFORMATIONAL STATES DICTATE SELECTIVITY T NATIVE SUBSTRATE IN A SUBSTRATE-PERMISSIVE ACYLTRAN BIOCHEMISTRY V. 55 6314 2016
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 5KJW - 53C C8 H8 O2 CC(=O)c1cc....
70% Homology Family (5)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 277 families.
1 5KJW - 53C C8 H8 O2 CC(=O)c1cc....
2 5FAN - DHB C7 H6 O4 c1cc(c(cc1....
3 4KEC - COA C21 H36 N7 O16 P3 S CC(C)(CO[P....
4 5FAL - COA C21 H36 N7 O16 P3 S CC(C)(CO[P....
5 5KJU - 6TO C16 H16 O7 c1cc(ccc1/....
50% Homology Family (5)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 212 families.
1 5KJW - 53C C8 H8 O2 CC(=O)c1cc....
2 5FAN - DHB C7 H6 O4 c1cc(c(cc1....
3 4KEC - COA C21 H36 N7 O16 P3 S CC(C)(CO[P....
4 5FAL - COA C21 H36 N7 O16 P3 S CC(C)(CO[P....
5 5KJU - 6TO C16 H16 O7 c1cc(ccc1/....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: 53C; Similar ligands found: 6
No: Ligand ECFP6 Tc MDL keys Tc
1 53C 1 1
2 3HB 0.59375 0.764706
3 A29 0.527778 0.65
4 RCO 0.428571 0.705882
5 IQQ 0.418605 0.65
6 AC6 0.411765 1
Similar Ligands (3D)
Ligand no: 1; Ligand: 53C; Similar ligands found: 1366
No: Ligand Similarity coefficient
1 GAB 1.0000
2 OVV 1.0000
3 3AB 1.0000
4 3NT 1.0000
5 8GC 1.0000
6 5HN 1.0000
7 3BZ 1.0000
8 WCE 1.0000
9 NMJ 1.0000
10 4CS 1.0000
11 3OC 1.0000
12 BRT 0.9977
13 1P3 0.9830
14 JBK 0.9760
15 DBH 0.9752
16 4NC 0.9746
17 3F0 0.9742
18 3HA 0.9741
19 J9T 0.9731
20 3M0 0.9728
21 FE DB1 0.9726
22 BEZ 0.9723
23 BEN 0.9709
24 OVM 0.9703
25 DHB 0.9703
26 HHA 0.9696
27 3MB 0.9695
28 NCA 0.9693
29 7MU 0.9688
30 6CS 0.9678
31 UNU 0.9674
32 6PC 0.9674
33 ORO 0.9674
34 OW4 0.9668
35 NIO 0.9666
36 AC0 0.9666
37 GTQ 0.9665
38 GYE 0.9664
39 BAM 0.9664
40 PBC 0.9656
41 INO 0.9655
42 XX2 0.9654
43 4A3 0.9652
44 PZA 0.9651
45 93K 0.9651
46 D1X 0.9651
47 9TW 0.9650
48 2HO 0.9646
49 3HM 0.9644
50 QSC 0.9643
51 OXC 0.9642
52 P9P 0.9642
53 YCP 0.9638
54 BE7 0.9636
55 54G 0.9635
56 NNO 0.9634
57 CHB 0.9632
58 MYJ 0.9631
59 5RG 0.9630
60 NBZ 0.9628
61 VGL 0.9626
62 5M0 0.9624
63 AW5 0.9621
64 34D 0.9619
65 FHB 0.9619
66 NTN 0.9617
67 069 0.9610
68 XCZ 0.9609
69 MLT 0.9607
70 DOR 0.9600
71 5MK 0.9596
72 6M9 0.9595
73 JZ7 0.9589
74 ES6 0.9588
75 FBW 0.9584
76 RSO 0.9584
77 BNS 0.9580
78 51R 0.9580
79 45L 0.9579
80 2AL 0.9570
81 3U4 0.9568
82 SS1 0.9568
83 IHB 0.9567
84 SX1 0.9561
85 BE2 0.9560
86 SAL 0.9559
87 4SV 0.9549
88 QSB 0.9547
89 OAA 0.9545
90 14J 0.9544
91 F60 0.9544
92 OVP 0.9543
93 PZI 0.9538
94 ASC 0.9538
95 9TZ 0.9538
96 M58 0.9529
97 1P7 0.9525
98 UGC 0.9521
99 JAE 0.9518
100 3ID 0.9516
101 5H1 0.9516
102 6M4 0.9515
103 FAN 0.9515
104 DYA 0.9513
105 3SK 0.9513
106 2K4 0.9510
107 6AI 0.9507
108 3DO 0.9506
109 14O 0.9505
110 IFM 0.9504
111 9EW 0.9502
112 HLR 0.9502
113 0RW 0.9501
114 F05 0.9500
115 IT2 0.9494
116 5MI 0.9492
117 VNL 0.9490
118 AHR 0.9488
119 DHK 0.9483
120 5MB 0.9482
121 TEO 0.9482
122 BZX 0.9481
123 ISZ 0.9480
124 F31 0.9479
125 VNJ 0.9479
126 1LQ 0.9472
127 5B1 0.9471
128 LMR 0.9470
129 R8S 0.9470
130 M1E 0.9467
131 KOJ 0.9467
132 PHU 0.9462
133 AMC 0.9461
134 ASP 0.9460
135 HY1 0.9459
136 GIF 0.9459
137 DMD 0.9458
138 PCA 0.9456
139 HPA 0.9455
140 SJ5 0.9454
141 ZXD 0.9451
142 SVN 0.9451
143 I3A 0.9448
144 N5J 0.9446
145 FQI 0.9446
146 C2A 0.9446
147 11S 0.9443
148 BZ3 0.9442
149 4XR 0.9441
150 TIU 0.9440
151 ES9 0.9439
152 1SQ 0.9438
153 GUN 0.9437
154 7HQ 0.9437
155 SHA 0.9432
156 IJZ 0.9431
157 XYL 0.9430
158 JBH 0.9429
159 SS2 0.9429
160 BHO 0.9428
161 FOT 0.9427
162 5OB 0.9427
163 COU 0.9427
164 CFI 0.9426
165 L3Q 0.9423
166 1WD 0.9423
167 JKE 0.9423
168 JFJ 0.9422
169 AGK 0.9422
170 1NP 0.9422
171 2AQ 0.9422
172 L99 0.9422
173 GAG 0.9421
174 JLZ 0.9420
175 23A 0.9418
176 JPZ 0.9415
177 7WG 0.9415
178 QUZ 0.9415
179 UNC 0.9410
180 ADE 0.9410
181 1LM 0.9407
182 RM1 0.9406
183 2DR 0.9404
184 OCH 0.9404
185 60P 0.9404
186 FK1 0.9404
187 LT2 0.9402
188 42C 0.9399
189 EYK 0.9399
190 ES1 0.9398
191 5IQ 0.9395
192 M1H 0.9391
193 FEH 0.9390
194 H4N 0.9390
195 5SG 0.9389
196 GBD 0.9388
197 PHB 0.9388
198 MNN 0.9385
199 3AL 0.9382
200 03V 0.9381
201 ES7 0.9381
202 AZA 0.9380
203 MXN 0.9378
204 XQ0 0.9377
205 SVD 0.9377
206 NPO 0.9377
207 4FS 0.9377
208 ADZ 0.9377
209 SKM 0.9375
210 PDC 0.9374
211 2A7 0.9373
212 5AC 0.9372
213 4YS 0.9371
214 F9P 0.9370
215 J9W 0.9370
216 A13 0.9370
217 HH8 0.9369
218 GZL 0.9368
219 EA1 0.9367
220 826 0.9367
221 JB5 0.9366
222 9DG 0.9366
223 NPY 0.9365
224 4XH 0.9365
225 5Q0 0.9364
226 M0W 0.9363
227 Q6T 0.9363
228 KKN 0.9360
229 OXZ 0.9358
230 ABV 0.9358
231 Q88 0.9354
232 XAN 0.9354
233 ES5 0.9353
234 ZZ3 0.9352
235 O72 0.9351
236 QY9 0.9351
237 6MP 0.9350
238 1DJ 0.9350
239 G4D 0.9349
240 7WV 0.9348
241 FBM 0.9348
242 9MG 0.9347
243 H42 0.9347
244 DFB 0.9345
245 LNR 0.9344
246 S76 0.9343
247 DBJ 0.9343
248 7B4 0.9343
249 CXF 0.9342
250 DHS 0.9341
251 I1E 0.9341
252 HLZ 0.9338
253 9DA 0.9338
254 X0V 0.9338
255 ISN 0.9337
256 1DW 0.9335
257 TLA 0.9334
258 PAB 0.9332
259 AX7 0.9331
260 4P5 0.9329
261 TPA 0.9327
262 SRT 0.9325
263 270 0.9325
264 BGC 0.9325
265 KUF 0.9324
266 GDE 0.9324
267 2RH 0.9322
268 AKH 0.9321
269 ICO 0.9321
270 42A 0.9321
271 COI 0.9320
272 EUG 0.9320
273 4M4 0.9320
274 7NI 0.9320
275 4JT 0.9319
276 DEN 0.9319
277 AL0 0.9317
278 10L 0.9317
279 5RN 0.9317
280 5XC 0.9317
281 7VS 0.9315
282 Q24 0.9315
283 FGZ 0.9315
284 FB2 0.9315
285 HX3 0.9314
286 CWM 0.9314
287 M1Q 0.9313
288 G3E 0.9312
289 24W 0.9311
290 OXQ 0.9311
291 174 0.9310
292 8NY 0.9310
293 RSF 0.9309
294 YH7 0.9309
295 C2U 0.9309
296 LDP 0.9307
297 HQY 0.9307
298 IFP 0.9307
299 4MA 0.9307
300 HBX 0.9307
301 ABN 0.9307
302 2CK 0.9306
303 NIZ 0.9306
304 KBB 0.9305
305 3FH 0.9304
306 92K 0.9303
307 LCN 0.9302
308 SYN 0.9302
309 OK7 0.9301
310 HBD 0.9300
311 MUA 0.9300
312 PYF 0.9299
313 4SX 0.9299
314 0HN 0.9298
315 2MI 0.9298
316 QSH 0.9296
317 141 0.9296
318 9HX 0.9296
319 DIN 0.9296
320 PM6 0.9296
321 F0J 0.9295
322 AQO 0.9295
323 4FH 0.9295
324 QWN 0.9295
325 EKZ 0.9294
326 1Y6 0.9293
327 A2F 0.9292
328 FPI 0.9291
329 0W8 0.9290
330 PE0 0.9290
331 M5K 0.9290
332 5WV 0.9290
333 E7Z 0.9290
334 4HC 0.9289
335 AJ2 0.9289
336 1PT 0.9288
337 PMB 0.9287
338 G2F 0.9286
339 M0Q 0.9286
340 6AP 0.9286
341 282 0.9285
342 LZ1 0.9285
343 C21 0.9285
344 4HM 0.9285
345 BHA 0.9284
346 M1A 0.9284
347 7HP 0.9283
348 TH7 0.9283
349 0HO 0.9283
350 IND 0.9283
351 PBZ 0.9283
352 BTE 0.9282
353 M2K 0.9282
354 ET2 0.9282
355 BP1 0.9281
356 FA0 0.9281
357 5NU 0.9280
358 MRZ 0.9279
359 AZG 0.9279
360 LZM 0.9279
361 RB5 0.9278
362 NBE 0.9277
363 DOB 0.9277
364 A7W 0.9277
365 FP1 0.9274
366 MEW 0.9273
367 MRW 0.9273
368 7N0 0.9272
369 HJP 0.9272
370 Z82 0.9272
371 FYU 0.9272
372 CN0 0.9271
373 THE 0.9270
374 CWS 0.9268
375 0R1 0.9268
376 R8V 0.9267
377 F12 0.9267
378 PRO 0.9267
379 5CU 0.9267
380 L5V 0.9267
381 SW7 0.9266
382 URC 0.9266
383 DE5 0.9266
384 G5V 0.9266
385 HIS 0.9265
386 SAF 0.9265
387 7W4 0.9265
388 P3K 0.9264
389 DBX 0.9263
390 2ZM 0.9262
391 GLC 0.9261
392 3Z7 0.9260
393 ES0 0.9259
394 MPI 0.9259
395 SE2 0.9258
396 DA4 0.9255
397 Z6J 0.9254
398 3XX 0.9254
399 HSO 0.9253
400 3IT 0.9252
401 TP5 0.9252
402 VGD 0.9252
403 NOJ 0.9251
404 2HQ 0.9251
405 FBB 0.9251
406 HIO 0.9247
407 AZ8 0.9247
408 PD2 0.9246
409 GVH 0.9246
410 HQJ 0.9245
411 KT7 0.9243
412 J5I 0.9243
413 BDP 0.9242
414 GJZ 0.9241
415 3NY 0.9241
416 6NT 0.9241
417 BZF 0.9241
418 FBV 0.9241
419 ES2 0.9241
420 ABI 0.9240
421 OW7 0.9239
422 GLU 0.9239
423 CLW 0.9239
424 4M0 0.9239
425 P92 0.9239
426 EV0 0.9239
427 PYC 0.9238
428 JZ5 0.9237
429 D48 0.9236
430 MO8 0.9235
431 9CL 0.9235
432 7WA 0.9235
433 150 0.9235
434 XM0 0.9233
435 290 0.9232
436 3PF 0.9232
437 MZW 0.9232
438 6GU 0.9231
439 QBK 0.9231
440 1XM 0.9228
441 36R 0.9228
442 CRS 0.9225
443 86J 0.9223
444 V55 0.9223
445 BZI 0.9223
446 4AA 0.9221
447 JZ9 0.9221
448 TZE 0.9220
449 SMV 0.9220
450 261 0.9219
451 TZC 0.9219
452 AS3 0.9219
453 1MR 0.9218
454 K2T 0.9218
455 173 0.9218
456 M4T 0.9217
457 DIU 0.9217
458 IHG 0.9217
459 3Z8 0.9216
460 II6 0.9216
461 DX4 0.9216
462 JBE 0.9216
463 1XN 0.9215
464 IDM 0.9214
465 JZ3 0.9213
466 8G0 0.9212
467 RIB 0.9212
468 JBN 0.9212
469 HMU 0.9211
470 CFP 0.9211
471 IGA 0.9210
472 3R6 0.9209
473 DIE 0.9209
474 4ZC 0.9208
475 2LP 0.9207
476 2CQ 0.9207
477 ES4 0.9206
478 5QY 0.9206
479 QXW 0.9205
480 4Z4 0.9204
481 ASO 0.9204
482 FBU 0.9204
483 1DV 0.9204
484 K5W 0.9203
485 67N 0.9203
486 1WG 0.9203
487 284 0.9202
488 T9G 0.9202
489 PY7 0.9200
490 2HU 0.9200
491 JAW 0.9200
492 MJ2 0.9200
493 6LW 0.9199
494 2D0 0.9198
495 PAC 0.9198
496 1P8 0.9197
497 GCU 0.9195
498 0P6 0.9194
499 3A9 0.9194
500 75K 0.9192
501 FB1 0.9192
502 265 0.9189
503 HMH 0.9187
504 PKU 0.9187
505 717 0.9187
506 EDR 0.9185
507 IP0 0.9183
508 NK 0.9182
509 4WL 0.9182
510 NOY 0.9181
511 1F1 0.9180
512 5JQ 0.9179
513 KJH 0.9177
514 6NI 0.9176
515 42J 0.9176
516 MUC 0.9174
517 54D 0.9174
518 4NG 0.9173
519 BOA 0.9173
520 5NI 0.9173
521 0CT 0.9172
522 XLS 0.9169
523 MNM 0.9169
524 HGQ 0.9168
525 PEA 0.9167
526 92P 0.9165
527 BTY 0.9164
528 8CM 0.9163
529 C2Y 0.9162
530 8TX 0.9160
531 AZF 0.9160
532 DMJ 0.9159
533 AZ9 0.9157
534 4ZA 0.9157
535 25W 0.9156
536 MCT 0.9155
537 DGJ 0.9154
538 KTA 0.9154
539 H76 0.9153
540 XAZ 0.9153
541 4ME 0.9153
542 B3R 0.9153
543 RNS 0.9152
544 ADA 0.9152
545 DRL 0.9152
546 LEU 0.9152
547 QDK 0.9150
548 5VM 0.9150
549 45C 0.9150
550 PYJ 0.9149
551 HBA 0.9147
552 FA1 0.9147
553 IF7 0.9146
554 0R0 0.9146
555 0F9 0.9144
556 HQT 0.9144
557 TC7 0.9143
558 M2H 0.9143
559 AKG 0.9143
560 F81 0.9142
561 HQD 0.9141
562 4ZE 0.9140
563 GRE 0.9140
564 URA 0.9140
565 IFL 0.9139
566 XQG 0.9139
567 32X 0.9139
568 B55 0.9139
569 G3F 0.9138
570 4XS 0.9137
571 LYL 0.9136
572 XYP 0.9136
573 BVF 0.9135
574 1DU 0.9134
575 BSX 0.9134
576 2YU 0.9134
577 7W1 0.9134
578 MWP 0.9133
579 FUM 0.9133
580 HL5 0.9132
581 SR1 0.9131
582 2PC 0.9131
583 GAL 0.9131
584 MR1 0.9131
585 GLY GLY 0.9130
586 NDH 0.9130
587 5QX 0.9130
588 HSE 0.9130
589 URF 0.9130
590 3HP 0.9128
591 HH5 0.9128
592 PEP 0.9127
593 XUL 0.9126
594 HY3 0.9125
595 WBU 0.9123
596 TDR 0.9123
597 3CH 0.9122
598 2AC 0.9120
599 6RQ 0.9119
600 GTR 0.9118
601 4HO 0.9118
602 2LY 0.9118
603 4JJ 0.9118
604 FOA 0.9117
605 ZZT 0.9117
606 6OT 0.9116
607 SD4 0.9115
608 LDU 0.9114
609 MWM 0.9113
610 XYD 0.9113
611 PRS 0.9112
612 DNF 0.9112
613 F4Z 0.9111
614 0N7 0.9111
615 HXX 0.9110
616 XBZ 0.9109
617 2AK 0.9108
618 4H2 0.9108
619 CEE 0.9108
620 4P0 0.9107
621 TTL 0.9107
622 HYP 0.9107
623 2F6 0.9107
624 RNT 0.9107
625 LGC 0.9105
626 KDF 0.9105
627 OHG 0.9104
628 M3T 0.9103
629 GV9 0.9102
630 5JL 0.9102
631 4CL 0.9100
632 8WT 0.9100
633 HEW 0.9099
634 OMD 0.9099
635 XX3 0.9098
636 LG5 0.9098
637 JB8 0.9097
638 VXX 0.9097
639 LG3 0.9097
640 MRY 0.9095
641 2TQ 0.9094
642 EOL 0.9094
643 PEL 0.9093
644 ZBT 0.9091
645 JDN 0.9091
646 FBJ 0.9090
647 24B 0.9089
648 6M1 0.9089
649 ASN 0.9088
650 4XV 0.9087
651 KBG 0.9087
652 293 0.9087
653 SNE 0.9086
654 273 0.9085
655 CIG 0.9085
656 CYT 0.9084
657 PRZ 0.9083
658 A09 0.9083
659 RAT 0.9082
660 HT4 0.9082
661 263 0.9082
662 APY 0.9081
663 271 0.9080
664 69O 0.9078
665 CTS 0.9077
666 4JP 0.9077
667 5JC 0.9076
668 26D 0.9075
669 JZ4 0.9074
670 BCU 0.9074
671 DTL 0.9074
672 CRN 0.9074
673 GLA 0.9073
674 1AL 0.9073
675 8OZ 0.9072
676 1AB 0.9071
677 JZ2 0.9071
678 G6D 0.9071
679 34A 0.9070
680 QIC 0.9070
681 TM7 0.9069
682 DHQ 0.9069
683 PRY 0.9068
684 XBT 0.9068
685 B2J 0.9067
686 2FG 0.9065
687 27Y 0.9065
688 MZB 0.9064
689 4VP 0.9064
690 A1U 0.9063
691 GCS 0.9062
692 K34 0.9062
693 M6N 0.9062
694 51F 0.9062
695 6F0 0.9061
696 NXA 0.9061
697 12Q 0.9060
698 BR9 0.9060
699 8S0 0.9059
700 5GU 0.9058
701 7ME 0.9058
702 2PG 0.9056
703 AHB 0.9056
704 XSP 0.9056
705 2MP 0.9055
706 N2Z 0.9055
707 CTL 0.9054
708 463 0.9053
709 DHR 0.9053
710 2ZV 0.9053
711 HSM 0.9051
712 B62 0.9051
713 495 0.9050
714 52C 0.9049
715 XRG 0.9048
716 8IG 0.9047
717 3SL 0.9047
718 3DM 0.9045
719 ICP 0.9045
720 PYD 0.9045
721 URS 0.9043
722 N2I 0.9043
723 82I 0.9043
724 RMN 0.9042
725 TAR 0.9040
726 J9Q 0.9040
727 TYL 0.9040
728 TH0 0.9040
729 15L 0.9039
730 MZG 0.9039
731 GRO 0.9037
732 H7Y 0.9037
733 KJU 0.9037
734 TZL 0.9037
735 2EC 0.9037
736 B24 0.9037
737 KJY 0.9036
738 1MC 0.9036
739 8GF 0.9036
740 MWJ 0.9035
741 EQT 0.9034
742 BP9 0.9034
743 5UC 0.9033
744 2XX 0.9031
745 F9Y 0.9031
746 MAQ 0.9031
747 8K2 0.9029
748 1SA 0.9028
749 LXC 0.9028
750 0CU 0.9027
751 M3H 0.9027
752 AJV 0.9027
753 NCD 0.9025
754 329 0.9024
755 HHQ 0.9024
756 GUA 0.9024
757 286 0.9023
758 SIN 0.9023
759 S2G 0.9021
760 SMN 0.9020
761 GXY 0.9020
762 O2A 0.9017
763 3PG 0.9016
764 EDG 0.9016
765 BCP 0.9016
766 8ZE 0.9015
767 PBA 0.9015
768 KYD 0.9015
769 13P 0.9015
770 RAM 0.9013
771 SYV 0.9013
772 23W 0.9012
773 8WO 0.9011
774 SOR 0.9010
775 R20 0.9010
776 UAN 0.9010
777 CWJ 0.9010
778 IPZ 0.9010
779 HCS 0.9009
780 9RW 0.9008
781 MAN 0.9008
782 MQN 0.9008
783 SC2 0.9008
784 DS0 0.9007
785 R2B 0.9006
786 5XB 0.9006
787 J1Z 0.9006
788 0JD 0.9005
789 2A9 0.9005
790 OGA 0.9005
791 TSS 0.9005
792 JYD 0.9005
793 0TU 0.9004
794 JAB 0.9002
795 268 0.9000
796 MT0 0.9000
797 7WR 0.9000
798 MSN 0.8998
799 URP 0.8998
800 RJY 0.8997
801 NSP 0.8997
802 OHP 0.8997
803 FDB 0.8996
804 X05 0.8995
805 43M 0.8995
806 0LH 0.8992
807 4MU 0.8992
808 O7U 0.8992
809 SWA 0.8991
810 X09 0.8991
811 1M2 0.8991
812 WOO 0.8987
813 PXL 0.8987
814 5MH 0.8987
815 1LN 0.8987
816 94W 0.8986
817 B60 0.8986
818 OTR 0.8984
819 ALL 0.8984
820 4FA 0.8984
821 XHP 0.8983
822 6JN 0.8982
823 M4E 0.8981
824 FUD 0.8981
825 FCR 0.8981
826 JZ1 0.8981
827 3YP 0.8980
828 44V 0.8980
829 9FL 0.8980
830 URQ 0.8979
831 6ME 0.8978
832 44W 0.8977
833 HZQ 0.8977
834 5WY 0.8976
835 Y8I 0.8976
836 HDH 0.8976
837 DQU 0.8975
838 QPR 0.8974
839 PIY 0.8973
840 LSA 0.8973
841 GAF 0.8972
842 40E 0.8972
843 R8A 0.8971
844 GLY PRO 0.8970
845 3HG 0.8970
846 IV2 0.8970
847 ONR 0.8970
848 UY7 0.8969
849 9X7 0.8969
850 4NM 0.8969
851 X6X 0.8968
852 PEQ 0.8968
853 2EH 0.8968
854 4SD 0.8968
855 0V5 0.8967
856 E35 0.8967
857 GXL 0.8965
858 EVA 0.8965
859 23J 0.8965
860 SAN 0.8964
861 GZ3 0.8963
862 4JM 0.8963
863 NID 0.8963
864 2FY 0.8963
865 UFV 0.8963
866 TSU 0.8961
867 FRU 0.8960
868 1GP 0.8959
869 MEV 0.8959
870 4JQ 0.8959
871 XXR 0.8959
872 GCB 0.8959
873 FA3 0.8959
874 4YO 0.8958
875 ORN 0.8957
876 AFR 0.8957
877 SOE 0.8957
878 OTW 0.8956
879 ITN 0.8956
880 IDH 0.8955
881 12M 0.8955
882 F5B 0.8954
883 FBS 0.8954
884 G2H 0.8953
885 RHU 0.8953
886 KIV 0.8953
887 SKA 0.8952
888 D07 0.8952
889 XXG 0.8951
890 ICF 0.8951
891 E5X 0.8951
892 JTH 0.8951
893 280 0.8950
894 GIV 0.8949
895 SEP 0.8948
896 HQ9 0.8948
897 GLN 0.8948
898 ODO 0.8948
899 4RW 0.8947
900 RD4 0.8947
901 4J8 0.8947
902 LNO 0.8946
903 258 0.8946
904 AAS 0.8946
905 AMS 0.8946
906 6TZ 0.8944
907 5RO 0.8944
908 TT4 0.8943
909 GP9 0.8942
910 47J 0.8942
911 AEF 0.8942
912 BEA 0.8941
913 NCT 0.8941
914 GLY ALA 0.8940
915 1GN 0.8940
916 WOT 0.8940
917 NLE 0.8939
918 JND 0.8939
919 TWO 0.8939
920 XIY 0.8937
921 4JL 0.8937
922 PBE 0.8936
923 2HG 0.8936
924 H3M 0.8936
925 149 0.8934
926 7ZE 0.8934
927 M6W 0.8933
928 0TR 0.8933
929 MS9 0.8932
930 PA1 0.8930
931 JXN 0.8930
932 0FO 0.8930
933 IPB 0.8930
934 2IT 0.8929
935 GGL 0.8929
936 AH8 0.8929
937 264 0.8929
938 APZ 0.8928
939 YIO 0.8927
940 B53 0.8927
941 DAS 0.8927
942 9CA 0.8926
943 1IT 0.8923
944 QMP 0.8922
945 4AV 0.8922
946 6UA 0.8922
947 3MG 0.8921
948 INE 0.8920
949 2ZQ 0.8918
950 N8Y 0.8918
951 N3W 0.8918
952 GVG 0.8917
953 6VD 0.8917
954 BK9 0.8916
955 PIM 0.8915
956 DUC 0.8915
957 MVN 0.8914
958 98J 0.8913
959 FPY 0.8913
960 LER 0.8911
961 BVC 0.8911
962 8H8 0.8910
963 AEH 0.8908
964 39A 0.8908
965 TFB 0.8907
966 G3P 0.8905
967 G3H 0.8905
968 5ZE 0.8905
969 LRH 0.8904
970 TLD 0.8904
971 ONL 0.8904
972 AX2 0.8903
973 NYL 0.8901
974 MBG 0.8900
975 GIO 0.8900
976 5WX 0.8900
977 T2C 0.8900
978 RBL 0.8899
979 HX2 0.8898
980 Z5P 0.8897
981 PQK 0.8897
982 ANN 0.8896
983 2H5 0.8895
984 SWD 0.8892
985 FBA 0.8890
986 P72 0.8887
987 SPV 0.8886
988 285 0.8886
989 KP6 0.8885
990 R67 0.8885
991 XYS 0.8884
992 DYT 0.8883
993 M45 0.8882
994 2BG 0.8880
995 7MH 0.8880
996 9YL 0.8880
997 C2B 0.8880
998 N7P 0.8879
999 EXO 0.8879
1000 2AS 0.8879
1001 HA5 0.8874
1002 HLD 0.8874
1003 SF9 0.8873
1004 QUS 0.8873
1005 BDF 0.8872
1006 9ON 0.8872
1007 1DQ 0.8871
1008 TAG 0.8870
1009 6MH 0.8869
1010 DGL 0.8866
1011 BMA 0.8866
1012 DHY 0.8866
1013 0GZ 0.8866
1014 DFU 0.8865
1015 TTY 0.8863
1016 15N 0.8862
1017 9R5 0.8862
1018 9FE 0.8862
1019 H8N 0.8861
1020 BR8 0.8861
1021 J9N 0.8861
1022 32O 0.8860
1023 OTD 0.8860
1024 97T 0.8859
1025 HPS 0.8859
1026 FH2 0.8859
1027 RXA 0.8858
1028 4JO 0.8857
1029 275 0.8857
1030 HPY 0.8857
1031 13X 0.8857
1032 GOO 0.8855
1033 VOH 0.8853
1034 B85 0.8853
1035 3BU 0.8853
1036 GLT 0.8853
1037 PYG 0.8852
1038 BZ2 0.8852
1039 DIG 0.8850
1040 LFR 0.8850
1041 0MK 0.8849
1042 N8P 0.8849
1043 MAE 0.8849
1044 ABE 0.8848
1045 3C4 0.8847
1046 FW5 0.8845
1047 KDV 0.8845
1048 IUR 0.8844
1049 BNF 0.8844
1050 ARB 0.8844
1051 LLQ 0.8844
1052 FBT 0.8843
1053 7CZ 0.8840
1054 QOS 0.8840
1055 SRO 0.8839
1056 FDK 0.8839
1057 N4B 0.8838
1058 FUL 0.8838
1059 64K 0.8838
1060 B57 0.8838
1061 LKA 0.8835
1062 TOF 0.8834
1063 3CE 0.8833
1064 PFL 0.8833
1065 JA8 0.8832
1066 3WA 0.8832
1067 E1T 0.8831
1068 XDE 0.8830
1069 GOJ 0.8829
1070 5AN 0.8829
1071 TRC 0.8828
1072 YRL 0.8828
1073 2ZX 0.8827
1074 AOS 0.8825
1075 2CM 0.8825
1076 FPK 0.8824
1077 AX3 0.8824
1078 FUC 0.8823
1079 KMH 0.8823
1080 4TU 0.8822
1081 T6C 0.8822
1082 RIP 0.8819
1083 ILE 0.8818
1084 SXS 0.8818
1085 3AY 0.8816
1086 MAK 0.8816
1087 6FZ 0.8815
1088 2MY 0.8815
1089 8EW 0.8814
1090 NVA 0.8813
1091 TGX 0.8813
1092 FCA 0.8812
1093 MET 0.8811
1094 MAJ 0.8810
1095 MBD 0.8810
1096 95Z 0.8809
1097 SYA 0.8808
1098 NQ 0.8808
1099 HVQ 0.8808
1100 DGN 0.8804
1101 PNZ 0.8804
1102 DUB 0.8800
1103 2FQ 0.8800
1104 ICB 0.8797
1105 R9S 0.8796
1106 PHE 0.8796
1107 2HC 0.8795
1108 AJY 0.8795
1109 JIF 0.8794
1110 39O 0.8793
1111 TRA 0.8790
1112 XXP 0.8790
1113 3ZQ 0.8790
1114 278 0.8790
1115 TSR 0.8789
1116 152 0.8789
1117 WDL 0.8788
1118 SHG 0.8787
1119 3MC 0.8785
1120 PGH 0.8783
1121 MPV 0.8783
1122 I2M 0.8782
1123 FLC 0.8780
1124 VK3 0.8780
1125 3FA 0.8780
1126 ZWZ 0.8778
1127 ERH 0.8778
1128 C9E 0.8776
1129 PRA 0.8775
1130 PEY 0.8775
1131 2C9 0.8774
1132 P4B 0.8773
1133 0W1 0.8773
1134 3QM 0.8772
1135 15E 0.8772
1136 SDD 0.8772
1137 5CL 0.8771
1138 NVI 0.8771
1139 1XA 0.8771
1140 JBQ 0.8770
1141 NVU 0.8770
1142 DQA 0.8769
1143 MLE 0.8767
1144 KIA 0.8765
1145 CIZ 0.8765
1146 PAH 0.8764
1147 TM4 0.8762
1148 35C 0.8762
1149 259 0.8762
1150 I4B 0.8762
1151 QWW 0.8761
1152 GLY CYS 0.8760
1153 SIF 0.8760
1154 PEZ 0.8759
1155 9KT 0.8758
1156 PGA 0.8758
1157 AN0 0.8757
1158 3MH 0.8757
1159 GMN 0.8756
1160 PYQ 0.8756
1161 CH9 0.8756
1162 6XI 0.8756
1163 M1Z 0.8754
1164 PRF 0.8754
1165 DNC 0.8753
1166 091 0.8752
1167 9ZE 0.8751
1168 FK8 0.8748
1169 TEP 0.8747
1170 G1O 0.8746
1171 TCZ 0.8746
1172 DAL DAL 0.8743
1173 94N 0.8743
1174 EGR 0.8742
1175 GLO 0.8741
1176 AY4 0.8741
1177 JUG 0.8740
1178 0OC 0.8739
1179 AHN 0.8739
1180 2FT 0.8737
1181 ZGL 0.8736
1182 FLM 0.8734
1183 SME 0.8732
1184 F4E 0.8732
1185 ARA 0.8731
1186 NDM 0.8729
1187 FFP 0.8728
1188 HAI 0.8728
1189 4V2 0.8727
1190 MED 0.8727
1191 9KH 0.8726
1192 PQ0 0.8725
1193 PMF 0.8724
1194 IZC 0.8724
1195 4JU 0.8724
1196 JFD 0.8721
1197 FUF 0.8719
1198 1QP 0.8717
1199 APG 0.8717
1200 IWT 0.8717
1201 PSV 0.8716
1202 M44 0.8714
1203 PLQ 0.8712
1204 NEQ 0.8712
1205 INS 0.8709
1206 QX4 0.8709
1207 OSE 0.8708
1208 Q71 0.8707
1209 KFH 0.8707
1210 2MH 0.8707
1211 PHT 0.8706
1212 N6C 0.8705
1213 CDV 0.8704
1214 PZM 0.8704
1215 Q7A 0.8703
1216 SKG 0.8702
1217 HDA 0.8702
1218 3MA 0.8700
1219 CXL 0.8699
1220 PJW 0.8697
1221 24T 0.8697
1222 ECE 0.8697
1223 Q02 0.8695
1224 E60 0.8694
1225 ZB1 0.8692
1226 IOM 0.8691
1227 H62 0.8691
1228 CSS 0.8690
1229 JG8 0.8689
1230 AMH 0.8688
1231 DEE 0.8688
1232 HC4 0.8688
1233 3V4 0.8687
1234 UEG 0.8687
1235 ESX 0.8687
1236 CMS 0.8686
1237 DMG 0.8686
1238 HQE 0.8685
1239 4MV 0.8685
1240 J6W 0.8684
1241 L22 0.8683
1242 CIT 0.8683
1243 QX2 0.8683
1244 DTU 0.8682
1245 8XL 0.8681
1246 DA1 0.8681
1247 2CL 0.8681
1248 CFF 0.8680
1249 1U6 0.8680
1250 KIB 0.8679
1251 SYM 0.8678
1252 XDK 0.8678
1253 CYH 0.8678
1254 IAC 0.8677
1255 9TY 0.8671
1256 EN1 0.8671
1257 BVG 0.8671
1258 SPA 0.8668
1259 AUD 0.8668
1260 NTM 0.8666
1261 FPN 0.8666
1262 HHH 0.8666
1263 KMT 0.8665
1264 DZX 0.8665
1265 ADK 0.8665
1266 CPZ 0.8665
1267 40O 0.8665
1268 7UC 0.8663
1269 THR 0.8663
1270 ACH 0.8663
1271 PCR 0.8661
1272 TBP 0.8660
1273 SF6 0.8656
1274 LG4 0.8655
1275 CAQ 0.8655
1276 ISE 0.8655
1277 7B3 0.8654
1278 LYS 0.8654
1279 269 0.8653
1280 6R8 0.8653
1281 PXM 0.8651
1282 3RK 0.8651
1283 46P 0.8648
1284 RUY 0.8647
1285 VAL 0.8646
1286 MT5 0.8645
1287 7VP 0.8644
1288 JRB 0.8644
1289 RUU 0.8642
1290 PXY 0.8642
1291 GXE 0.8641
1292 ICC 0.8640
1293 7VJ 0.8639
1294 C5J 0.8639
1295 BPN 0.8639
1296 DII 0.8638
1297 37T 0.8637
1298 4A5 0.8636
1299 5NE 0.8635
1300 YHO 0.8635
1301 HNQ 0.8634
1302 MZ0 0.8634
1303 PHH 0.8628
1304 MLA 0.8626
1305 GCO 0.8626
1306 428 0.8625
1307 MFB 0.8621
1308 25R 0.8619
1309 MSR 0.8619
1310 9PY 0.8618
1311 I6G 0.8614
1312 RBJ 0.8614
1313 MEQ 0.8613
1314 TFU 0.8610
1315 449 0.8609
1316 QBM 0.8607
1317 4VY 0.8605
1318 36Y 0.8604
1319 CEJ 0.8601
1320 AIN 0.8600
1321 2CH 0.8600
1322 1XX 0.8598
1323 4HS 0.8597
1324 92Z 0.8597
1325 SNU 0.8596
1326 4CH 0.8594
1327 8GL 0.8592
1328 BML 0.8592
1329 HIU 0.8592
1330 YSO 0.8591
1331 791 0.8590
1332 R9Y 0.8589
1333 PSJ 0.8588
1334 2KT 0.8586
1335 P2D 0.8586
1336 MLI 0.8582
1337 BNL 0.8582
1338 7MX 0.8581
1339 PH3 0.8579
1340 PFB 0.8579
1341 G8M 0.8573
1342 3PY 0.8570
1343 CLZ 0.8569
1344 IPH 0.8567
1345 FLA 0.8565
1346 RM4 0.8560
1347 ICT 0.8559
1348 JXZ 0.8559
1349 FCB 0.8558
1350 25T 0.8557
1351 HHN 0.8557
1352 K17 0.8550
1353 8CL 0.8543
1354 V1L 0.8542
1355 HGW 0.8541
1356 K97 0.8540
1357 ESI 0.8540
1358 BEW 0.8538
1359 2IM 0.8535
1360 L89 0.8532
1361 E7S 0.8530
1362 W81 0.8529
1363 SN4 0.8526
1364 PH2 0.8520
1365 HYN 0.8518
1366 9X6 0.8517
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 5KJW; Ligand: 53C; 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: 5kjw.bio1) has 12 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 5KJW; Ligand: 53C; 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: 5kjw.bio2) has 11 residues
No: Leader PDB Ligand Sequence Similarity
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