Receptor
PDB id Resolution Class Description Source Keywords
5IXE 1.75 Å EC: 3.2.1.21 1.75A RESOLUTION STRUCTURE OF 5-FLUOROINDOLE BOUND BETA-GLYC (W33G) FROM SULFOLOBUS SOLFATARICUS SULFOLOBUS SOLFATARICUS GLYCOSIDE HYDROLASE ALLOSTERIC ACTIVATION SWITCHABLE ENZYMCHEMICAL RESCUE HYDROLASE
Ref.: FULL AND PARTIAL AGONISM OF A DESIGNED ENZYME SWITC ACS SYNTH BIOL V. 5 1475 2016
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
14O B:501;
A:501;
 Valid;
Valid;
 none;
none;
 Kd = 2.3 mM
135.138 C8 H6 F N c1cc2...
MPD A:502;
 Invalid;
 none;
 submit data
118.174 C6 H14 O2 C[C@@...
CL A:503;
B:504;
A:504;
B:503;
B:502;
A:505;
 Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
 none;
none;
none;
none;
none;
none;
 submit data
35.453 Cl [Cl-]
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
2CER 2.29 Å EC: 3.2.1.21 BETA-GLYCOSIDASE FROM SULFOLOBUS SOLFATARICUS IN COMPLEX WITH PHENETHYL-SUBSTITUTED GLUCOIMIDAZOLE SULFOLOBUS SOLFATARICUS GLYCOSIDE HYDROLASE INHIBITOR TRANSITION STATE MIMIC FAMILY 1 GLUCOIMIDAZOLE HYDROLASE
Ref.: STRUCTURAL, KINETIC, AND THERMODYNAMIC ANALYSIS OF GLUCOIMIDAZOLE-DERIVED GLYCOSIDASE INHIBITORS. BIOCHEMISTRY V. 45 11879 2006
Members (6)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 25 families.
1 2CER Ki < 0.6 nM PGI C16 H21 N2 O4 c1ccc(cc1)....
2 5IXE Kd = 2.3 mM 14O C8 H6 F N c1cc2c(cc[....
3 4EAN - IND C8 H7 N c1ccc2c(c1....
4 1UWU Ki = 1.04 uM GOX C6 H12 N2 O5 C([C@@H]1[....
5 1UWT Ki = 1.08 uM GTL C6 H12 N2 O5 C([C@@H]1[....
6 2CEQ Ki = 53 nM GIM C8 H13 N2 O4 c1c[n+]2c(....
70% Homology Family (6)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 22 families.
1 2CER Ki < 0.6 nM PGI C16 H21 N2 O4 c1ccc(cc1)....
2 5IXE Kd = 2.3 mM 14O C8 H6 F N c1cc2c(cc[....
3 4EAN - IND C8 H7 N c1ccc2c(c1....
4 1UWU Ki = 1.04 uM GOX C6 H12 N2 O5 C([C@@H]1[....
5 1UWT Ki = 1.08 uM GTL C6 H12 N2 O5 C([C@@H]1[....
6 2CEQ Ki = 53 nM GIM C8 H13 N2 O4 c1c[n+]2c(....
50% Homology Family (6)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 6 families.
1 2CER Ki < 0.6 nM PGI C16 H21 N2 O4 c1ccc(cc1)....
2 5IXE Kd = 2.3 mM 14O C8 H6 F N c1cc2c(cc[....
3 4EAN - IND C8 H7 N c1ccc2c(c1....
4 1UWU Ki = 1.04 uM GOX C6 H12 N2 O5 C([C@@H]1[....
5 1UWT Ki = 1.08 uM GTL C6 H12 N2 O5 C([C@@H]1[....
6 2CEQ Ki = 53 nM GIM C8 H13 N2 O4 c1c[n+]2c(....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: 14O; Similar ligands found: 4
No: Ligand ECFP6 Tc MDL keys Tc
1 14O 1 1
2 5MI 0.461538 0.75
3 11S 0.461538 0.9
4 H4N 0.45 0.9
Similar Ligands (3D)
Ligand no: 1; Ligand: 14O; Similar ligands found: 1276
No: Ligand Similarity coefficient
1 5MB 1.0000
2 5H1 1.0000
3 F60 1.0000
4 BZX 1.0000
5 2K4 1.0000
6 6AI 1.0000
7 ES9 0.9977
8 JAE 0.9959
9 FK1 0.9937
10 COU 0.9887
11 4FS 0.9876
12 H42 0.9870
13 JB5 0.9860
14 03V 0.9847
15 OCH 0.9838
16 2AQ 0.9838
17 ES5 0.9837
18 8NY 0.9837
19 NPO 0.9831
20 ET2 0.9804
21 5OB 0.9777
22 ABV 0.9774
23 VGD 0.9770
24 QUZ 0.9761
25 PHB 0.9758
26 5WV 0.9743
27 NPY 0.9740
28 DEN 0.9739
29 CLW 0.9735
30 6M9 0.9732
31 BZ3 0.9731
32 36R 0.9730
33 9DG 0.9726
34 AX7 0.9722
35 ES2 0.9713
36 ISN 0.9713
37 1P7 0.9710
38 IND 0.9710
39 AZA 0.9707
40 OAA 0.9704
41 XQ0 0.9703
42 1P8 0.9702
43 0CT 0.9702
44 BZI 0.9701
45 5XC 0.9699
46 BEZ 0.9698
47 MR1 0.9696
48 RM1 0.9695
49 GUN 0.9692
50 8GC 0.9692
51 RSF 0.9690
52 6GU 0.9688
53 TH7 0.9687
54 YCP 0.9687
55 9EW 0.9684
56 XAN 0.9683
57 BZF 0.9683
58 PAB 0.9682
59 3ID 0.9680
60 7W4 0.9680
61 270 0.9679
62 A2F 0.9679
63 1PT 0.9679
64 XYP 0.9679
65 LZ1 0.9678
66 BAM 0.9678
67 4JP 0.9677
68 AHR 0.9677
69 6PC 0.9675
70 2MI 0.9674
71 5VM 0.9673
72 0RW 0.9673
73 KKN 0.9672
74 M1A 0.9670
75 BEN 0.9670
76 ES7 0.9667
77 5B1 0.9667
78 67N 0.9667
79 F05 0.9666
80 MPI 0.9665
81 NCA 0.9664
82 DMD 0.9663
83 6AP 0.9661
84 AZG 0.9657
85 DX4 0.9655
86 SAL 0.9654
87 0R1 0.9652
88 GVH 0.9648
89 1DW 0.9648
90 141 0.9645
91 6M4 0.9645
92 FBB 0.9641
93 HMH 0.9639
94 IGA 0.9637
95 1Y6 0.9635
96 K2T 0.9634
97 HBD 0.9634
98 LXC 0.9628
99 IDM 0.9626
100 GLC 0.9626
101 JBE 0.9625
102 4CS 0.9621
103 I3A 0.9620
104 F9Y 0.9620
105 HH5 0.9614
106 FYU 0.9612
107 MCT 0.9611
108 7HQ 0.9610
109 2CK 0.9610
110 NIO 0.9609
111 SVN 0.9604
112 1XM 0.9603
113 NBZ 0.9602
114 XM0 0.9602
115 YH7 0.9601
116 4JT 0.9600
117 TH0 0.9599
118 290 0.9598
119 8H8 0.9598
120 CFP 0.9596
121 AZ8 0.9591
122 NTN 0.9591
123 ISZ 0.9590
124 3AB 0.9590
125 QWN 0.9586
126 4SV 0.9586
127 0CU 0.9582
128 5NU 0.9581
129 5CU 0.9580
130 3F0 0.9577
131 HBA 0.9574
132 5RG 0.9574
133 NOJ 0.9574
134 GAB 0.9573
135 173 0.9572
136 NK 0.9571
137 3U4 0.9566
138 BCP 0.9566
139 ES6 0.9565
140 BGC 0.9565
141 BOA 0.9562
142 BE2 0.9561
143 3HB 0.9557
144 5HN 0.9555
145 MEW 0.9553
146 4HO 0.9553
147 MLT 0.9552
148 2HQ 0.9549
149 3PF 0.9549
150 3NT 0.9547
151 URF 0.9547
152 717 0.9545
153 VGL 0.9541
154 4M0 0.9540
155 QXW 0.9539
156 PBZ 0.9536
157 PE0 0.9534
158 Q24 0.9532
159 FA0 0.9530
160 PZA 0.9530
161 HLR 0.9527
162 AC0 0.9527
163 UNU 0.9525
164 4XR 0.9525
165 DOB 0.9524
166 LZM 0.9521
167 JA8 0.9520
168 5QY 0.9520
169 EA1 0.9517
170 KJH 0.9517
171 3M0 0.9517
172 DBH 0.9515
173 MWM 0.9514
174 MZG 0.9512
175 P92 0.9511
176 JZ9 0.9510
177 Z82 0.9510
178 HQY 0.9509
179 BHO 0.9509
180 86J 0.9508
181 1MC 0.9508
182 4MA 0.9507
183 NMJ 0.9506
184 53C 0.9505
185 5JC 0.9504
186 URC 0.9503
187 42A 0.9502
188 G3E 0.9502
189 174 0.9502
190 TTL 0.9501
191 5SG 0.9500
192 1SQ 0.9499
193 TDR 0.9499
194 4JU 0.9497
195 AQO 0.9495
196 12Q 0.9495
197 M5K 0.9494
198 14J 0.9493
199 826 0.9493
200 4HC 0.9492
201 CWS 0.9490
202 KOJ 0.9490
203 OVV 0.9488
204 HMU 0.9488
205 XBZ 0.9487
206 WCE 0.9487
207 5IQ 0.9486
208 3HA 0.9485
209 7W1 0.9485
210 Q88 0.9485
211 GTQ 0.9484
212 FE DB1 0.9481
213 5QX 0.9479
214 5UC 0.9479
215 2BG 0.9477
216 BHA 0.9477
217 XBT 0.9477
218 5Q0 0.9476
219 HQT 0.9476
220 CTL 0.9476
221 54D 0.9475
222 BE7 0.9475
223 ES1 0.9475
224 4ZE 0.9475
225 KUF 0.9475
226 PBC 0.9474
227 1LQ 0.9473
228 8ZE 0.9473
229 4VP 0.9472
230 BTY 0.9471
231 WBU 0.9469
232 5JQ 0.9464
233 SS1 0.9463
234 FQI 0.9462
235 AJ2 0.9461
236 SYV 0.9461
237 0R0 0.9460
238 4CL 0.9459
239 NIZ 0.9459
240 24B 0.9458
241 HPA 0.9456
242 JZ3 0.9452
243 5MH 0.9451
244 P72 0.9449
245 4YS 0.9449
246 D48 0.9449
247 MWJ 0.9449
248 1NP 0.9448
249 XIY 0.9447
250 2AC 0.9444
251 4JJ 0.9444
252 N5J 0.9442
253 XAZ 0.9441
254 FDB 0.9440
255 DHB 0.9438
256 PXL 0.9438
257 JPZ 0.9436
258 A7W 0.9434
259 2YU 0.9434
260 SW7 0.9433
261 0P6 0.9433
262 NSP 0.9432
263 27Y 0.9431
264 HIS 0.9431
265 2MH 0.9431
266 I1E 0.9430
267 CFI 0.9430
268 2CQ 0.9430
269 23A 0.9430
270 10L 0.9429
271 54G 0.9428
272 4P5 0.9428
273 ADE 0.9427
274 3OC 0.9427
275 3BZ 0.9426
276 6CS 0.9426
277 4XH 0.9425
278 75K 0.9424
279 ADZ 0.9423
280 B55 0.9423
281 ES0 0.9421
282 BP1 0.9421
283 XYD 0.9420
284 8CM 0.9420
285 5RN 0.9418
286 G3F 0.9418
287 7B4 0.9417
288 CWM 0.9416
289 JKE 0.9416
290 1WG 0.9415
291 1WD 0.9413
292 275 0.9413
293 1M2 0.9412
294 5M0 0.9412
295 4HM 0.9411
296 4NC 0.9409
297 BR9 0.9408
298 24W 0.9408
299 KJU 0.9408
300 BRT 0.9407
301 JZ2 0.9406
302 O72 0.9405
303 6MP 0.9403
304 ICP 0.9403
305 MQN 0.9402
306 34A 0.9402
307 7WA 0.9402
308 UGC 0.9401
309 J1Z 0.9401
310 FAN 0.9400
311 QBK 0.9400
312 9MG 0.9399
313 HQE 0.9399
314 2MP 0.9398
315 B53 0.9397
316 TP5 0.9395
317 PRO 0.9395
318 PLQ 0.9393
319 ES4 0.9391
320 DIN 0.9390
321 ZZT 0.9390
322 LG4 0.9390
323 MRW 0.9389
324 PYD 0.9389
325 OXQ 0.9389
326 SKA 0.9387
327 SE2 0.9386
328 QOS 0.9384
329 A1U 0.9384
330 6NT 0.9384
331 R8V 0.9384
332 J5I 0.9383
333 150 0.9382
334 4JQ 0.9381
335 HHA 0.9380
336 7WV 0.9380
337 2EC 0.9379
338 TPA 0.9377
339 G6D 0.9376
340 8TX 0.9375
341 FOA 0.9374
342 XYS 0.9373
343 GCS 0.9373
344 HT4 0.9371
345 FPY 0.9369
346 9DA 0.9368
347 0TR 0.9368
348 P9P 0.9368
349 HH8 0.9366
350 INO 0.9366
351 60P 0.9363
352 0TU 0.9359
353 ZBT 0.9359
354 GBD 0.9357
355 PM6 0.9357
356 DA1 0.9356
357 CRS 0.9355
358 7HP 0.9354
359 DYA 0.9354
360 H8N 0.9353
361 PCR 0.9353
362 M58 0.9352
363 43M 0.9351
364 2D0 0.9350
365 4YO 0.9348
366 HY3 0.9348
367 1DU 0.9348
368 BTE 0.9347
369 4ZC 0.9347
370 XX2 0.9346
371 JBH 0.9346
372 B57 0.9345
373 0JD 0.9345
374 N2I 0.9344
375 SWD 0.9343
376 TM7 0.9342
377 3NY 0.9342
378 25R 0.9342
379 5JL 0.9341
380 5MK 0.9341
381 LT2 0.9341
382 URP 0.9341
383 GAG 0.9340
384 SX1 0.9340
385 0HO 0.9340
386 JLZ 0.9339
387 PXY 0.9339
388 FPN 0.9338
389 TIU 0.9337
390 JBK 0.9336
391 MYJ 0.9336
392 AC6 0.9334
393 XQG 0.9333
394 IUR 0.9332
395 4JO 0.9332
396 2ZM 0.9331
397 NNO 0.9331
398 OK7 0.9330
399 3MB 0.9330
400 BSX 0.9328
401 RSO 0.9328
402 9HX 0.9327
403 4FA 0.9327
404 0HN 0.9325
405 7CZ 0.9325
406 25W 0.9324
407 3DM 0.9323
408 CWJ 0.9323
409 QSC 0.9323
410 82I 0.9323
411 M1E 0.9322
412 1F1 0.9322
413 6RQ 0.9320
414 FP1 0.9318
415 4A3 0.9317
416 5NI 0.9316
417 OVM 0.9315
418 F9P 0.9314
419 PYC 0.9313
420 FBM 0.9312
421 C21 0.9311
422 IFL 0.9310
423 IDH 0.9309
424 3SK 0.9308
425 M2K 0.9307
426 8S0 0.9307
427 1LM 0.9305
428 KDV 0.9305
429 AMC 0.9304
430 PNZ 0.9302
431 PZI 0.9301
432 RCO 0.9301
433 LMR 0.9300
434 ASO 0.9300
435 3XX 0.9300
436 4AA 0.9298
437 EQT 0.9296
438 5GU 0.9294
439 ICO 0.9294
440 282 0.9294
441 F81 0.9293
442 SOE 0.9293
443 45C 0.9292
444 4HS 0.9291
445 2HO 0.9290
446 8IG 0.9290
447 KT7 0.9290
448 3HM 0.9290
449 6NI 0.9290
450 5AC 0.9289
451 VNJ 0.9289
452 2HU 0.9287
453 261 0.9286
454 PKU 0.9286
455 FHB 0.9284
456 9TZ 0.9284
457 PCA 0.9283
458 51R 0.9283
459 93K 0.9282
460 FBA 0.9282
461 FPI 0.9282
462 BML 0.9281
463 PY7 0.9281
464 SYN 0.9280
465 284 0.9280
466 HBX 0.9273
467 IV2 0.9272
468 2PC 0.9272
469 FUL 0.9271
470 3CH 0.9269
471 IT2 0.9268
472 1DV 0.9267
473 E7Z 0.9265
474 JZ5 0.9264
475 1P3 0.9263
476 ABI 0.9260
477 BCU 0.9258
478 SHA 0.9258
479 URA 0.9255
480 L3Q 0.9254
481 Y8I 0.9254
482 8OZ 0.9253
483 K34 0.9252
484 FCR 0.9251
485 TZC 0.9251
486 PEA 0.9249
487 RIP 0.9248
488 JAW 0.9247
489 4WL 0.9247
490 DHR 0.9245
491 4CH 0.9245
492 3Z8 0.9245
493 94W 0.9243
494 B62 0.9242
495 AZ9 0.9241
496 NDH 0.9240
497 6M1 0.9240
498 CYT 0.9240
499 4BZ 0.9239
500 F4Z 0.9236
501 RHU 0.9236
502 4JM 0.9236
503 ABN 0.9235
504 2ZV 0.9234
505 G2F 0.9234
506 273 0.9234
507 MUA 0.9233
508 PHU 0.9230
509 ANN 0.9230
510 MAE 0.9230
511 CHB 0.9229
512 4JL 0.9227
513 3A9 0.9226
514 6F0 0.9226
515 TC7 0.9226
516 GYE 0.9224
517 AKG 0.9224
518 0MK 0.9222
519 ARB 0.9221
520 G5V 0.9220
521 GRE 0.9220
522 7VS 0.9220
523 PYF 0.9217
524 LG3 0.9217
525 0W8 0.9217
526 GAL 0.9216
527 J9Q 0.9216
528 TSU 0.9212
529 PYG 0.9211
530 4JN 0.9210
531 8WO 0.9209
532 ASP 0.9209
533 EUG 0.9207
534 286 0.9206
535 SRT 0.9206
536 BVF 0.9206
537 OW4 0.9205
538 7NI 0.9205
539 DBX 0.9205
540 9TW 0.9203
541 MWP 0.9202
542 265 0.9201
543 HX3 0.9201
544 TLD 0.9201
545 DRL 0.9201
546 3Z7 0.9200
547 BPN 0.9200
548 C2B 0.9199
549 HDH 0.9195
550 HGQ 0.9195
551 JBN 0.9194
552 XRG 0.9194
553 DFB 0.9193
554 9R5 0.9190
555 FUC 0.9189
556 1XN 0.9188
557 3DO 0.9187
558 J9W 0.9185
559 QWW 0.9184
560 32X 0.9184
561 LG5 0.9182
562 2A9 0.9180
563 7MU 0.9179
564 2LP 0.9178
565 JBQ 0.9176
566 92K 0.9175
567 XHP 0.9175
568 DFU 0.9174
569 RMN 0.9174
570 SAN 0.9174
571 7WG 0.9172
572 OTW 0.9171
573 0FO 0.9171
574 E5X 0.9170
575 WOT 0.9170
576 3FH 0.9169
577 DTL 0.9169
578 ODO 0.9168
579 9FL 0.9167
580 SMV 0.9166
581 J9T 0.9165
582 DHQ 0.9164
583 26D 0.9163
584 UNC 0.9163
585 P3K 0.9161
586 TSS 0.9161
587 3ZQ 0.9161
588 IHB 0.9159
589 QSB 0.9157
590 PBA 0.9156
591 R9S 0.9154
592 IOL 0.9153
593 B3R 0.9153
594 F0J 0.9152
595 EKZ 0.9151
596 DE5 0.9150
597 44W 0.9150
598 M2H 0.9148
599 MO8 0.9145
600 MNM 0.9144
601 FBV 0.9142
602 NQ 0.9142
603 HEW 0.9142
604 OHG 0.9142
605 M1Q 0.9141
606 IPB 0.9140
607 QX4 0.9140
608 TLA 0.9139
609 AEF 0.9138
610 3WA 0.9138
611 YRL 0.9138
612 JIF 0.9135
613 8WT 0.9134
614 HLZ 0.9133
615 N8Y 0.9132
616 JDN 0.9132
617 JAB 0.9132
618 TEO 0.9132
619 MZW 0.9130
620 OXC 0.9130
621 OTR 0.9129
622 DGJ 0.9128
623 MS9 0.9127
624 GLA 0.9127
625 BEA 0.9126
626 4ZA 0.9125
627 M3T 0.9124
628 NOY 0.9124
629 M6N 0.9122
630 42C 0.9122
631 TGX 0.9121
632 T6C 0.9121
633 BDP 0.9121
634 IFP 0.9119
635 QX2 0.9118
636 Q6T 0.9116
637 MAK 0.9115
638 2AK 0.9114
639 8GF 0.9113
640 V55 0.9112
641 4H2 0.9112
642 MBD 0.9112
643 F5B 0.9111
644 RXA 0.9110
645 NBE 0.9109
646 HQD 0.9107
647 2AL 0.9106
648 KJY 0.9104
649 5RO 0.9104
650 3FA 0.9103
651 TFB 0.9103
652 VK3 0.9102
653 LGC 0.9101
654 DQU 0.9100
655 3MC 0.9100
656 23W 0.9099
657 RIB 0.9099
658 AAS 0.9098
659 4Z4 0.9096
660 XUL 0.9096
661 M4T 0.9095
662 CIG 0.9095
663 15E 0.9092
664 97T 0.9091
665 7N0 0.9091
666 1MR 0.9090
667 JZ1 0.9088
668 OVP 0.9086
669 C2A 0.9086
670 GCU 0.9086
671 DUC 0.9084
672 PRZ 0.9083
673 IFM 0.9083
674 CTS 0.9082
675 HHQ 0.9079
676 4M4 0.9078
677 ORO 0.9077
678 PZM 0.9077
679 AJV 0.9076
680 VNL 0.9076
681 ECE 0.9076
682 GXY 0.9075
683 FBW 0.9075
684 AGK 0.9073
685 KYD 0.9070
686 RAM 0.9068
687 B60 0.9067
688 35C 0.9067
689 FB2 0.9067
690 MVN 0.9066
691 GIF 0.9065
692 3RK 0.9065
693 2C9 0.9064
694 3CE 0.9063
695 RB5 0.9062
696 MT0 0.9060
697 SN4 0.9060
698 2H5 0.9060
699 TM4 0.9059
700 F31 0.9059
701 HYP 0.9057
702 HIO 0.9055
703 6VD 0.9055
704 HSM 0.9055
705 FFP 0.9054
706 GMN 0.9053
707 GIO 0.9053
708 37T 0.9052
709 FCA 0.9050
710 4NM 0.9050
711 6MH 0.9050
712 L99 0.9050
713 AKH 0.9049
714 2FY 0.9048
715 PAC 0.9048
716 LDP 0.9048
717 FB1 0.9048
718 DIE 0.9048
719 GLL 0.9048
720 15N 0.9045
721 SWA 0.9045
722 2CM 0.9044
723 259 0.9043
724 CAQ 0.9043
725 TEP 0.9042
726 2MY 0.9041
727 0N7 0.9040
728 9CA 0.9039
729 FBS 0.9039
730 4MU 0.9038
731 2DR 0.9037
732 DBJ 0.9036
733 EYK 0.9036
734 OXE 0.9036
735 3SL 0.9036
736 R9Y 0.9036
737 XCZ 0.9034
738 ABE 0.9034
739 TMZ 0.9034
740 TTY 0.9034
741 LDU 0.9033
742 HZQ 0.9031
743 2FG 0.9031
744 HQJ 0.9031
745 XXR 0.9030
746 495 0.9028
747 1SA 0.9028
748 MLA 0.9028
749 2CH 0.9026
750 64K 0.9026
751 MAQ 0.9025
752 M6W 0.9024
753 BP9 0.9024
754 PDC 0.9024
755 GUA 0.9024
756 A29 0.9023
757 OXZ 0.9023
758 ISE 0.9021
759 FLM 0.9020
760 KIV 0.9020
761 NDM 0.9018
762 CXF 0.9018
763 ALL 0.9018
764 FOT 0.9017
765 44V 0.9017
766 PYQ 0.9014
767 HY1 0.9013
768 MNN 0.9012
769 K5W 0.9012
770 TAR 0.9011
771 H76 0.9011
772 MXN 0.9010
773 LCN 0.9010
774 WOO 0.9010
775 2A7 0.9009
776 1DQ 0.9008
777 J6W 0.9008
778 BZ2 0.9007
779 HSE 0.9007
780 HA5 0.9007
781 280 0.9007
782 069 0.9005
783 1DJ 0.9004
784 C2U 0.9003
785 LKA 0.9003
786 HJP 0.9002
787 AZF 0.9002
788 4J8 0.9002
789 DMG 0.9002
790 X0V 0.9001
791 7MH 0.9000
792 UY7 0.9000
793 39A 0.9000
794 PQ0 0.8999
795 PEL 0.8996
796 SHG 0.8996
797 DHK 0.8995
798 UAN 0.8994
799 ADK 0.8994
800 DUB 0.8993
801 INE 0.8993
802 MAN 0.8992
803 1IT 0.8991
804 ESP 0.8991
805 69O 0.8990
806 IF7 0.8990
807 9CL 0.8989
808 5WX 0.8989
809 6ME 0.8989
810 BEW 0.8988
811 PIM 0.8988
812 EXO 0.8987
813 SIN 0.8987
814 JND 0.8985
815 AW5 0.8982
816 NID 0.8981
817 6X8 0.8981
818 G4D 0.8980
819 JB8 0.8980
820 4TU 0.8979
821 DIU 0.8979
822 IP0 0.8979
823 L89 0.8978
824 40O 0.8978
825 P2D 0.8978
826 KBB 0.8977
827 PMB 0.8977
828 GOO 0.8976
829 AL0 0.8971
830 52C 0.8971
831 9X7 0.8970
832 HSO 0.8970
833 FBJ 0.8969
834 GAF 0.8969
835 GDE 0.8969
836 3BU 0.8968
837 34D 0.8966
838 E1T 0.8964
839 1AN 0.8962
840 5WY 0.8962
841 JFD 0.8961
842 DNF 0.8961
843 DOR 0.8961
844 4ME 0.8960
845 938 0.8956
846 MLI 0.8956
847 X05 0.8955
848 PA1 0.8953
849 7ZE 0.8952
850 92Z 0.8951
851 PRY 0.8950
852 T9G 0.8950
853 3MA 0.8949
854 3IT 0.8949
855 BMA 0.8949
856 HTS 0.8948
857 93Q 0.8947
858 268 0.8944
859 3MH 0.8943
860 0FN 0.8942
861 149 0.8942
862 2ZQ 0.8941
863 8LG 0.8940
864 9TY 0.8940
865 PIY 0.8940
866 23J 0.8937
867 GVG 0.8936
868 QY9 0.8935
869 ARA 0.8935
870 GZL 0.8935
871 APZ 0.8934
872 8K2 0.8934
873 4XX 0.8934
874 Z6J 0.8933
875 TYL 0.8931
876 25T 0.8931
877 PAF 0.8930
878 GLU 0.8930
879 S76 0.8928
880 2F6 0.8928
881 3R6 0.8926
882 FP2 0.8926
883 SKM 0.8926
884 FUD 0.8925
885 FRU 0.8925
886 VAL 0.8925
887 TBP 0.8924
888 EVA 0.8924
889 PD2 0.8923
890 RM4 0.8923
891 PRF 0.8921
892 FUM 0.8921
893 APG 0.8919
894 1U6 0.8919
895 MRZ 0.8918
896 LSA 0.8918
897 JZ4 0.8918
898 PRS 0.8917
899 THE 0.8917
900 X6X 0.8916
901 TMT 0.8911
902 FA1 0.8911
903 INS 0.8911
904 DMJ 0.8910
905 H3M 0.8910
906 R2B 0.8909
907 SRO 0.8907
908 XYL 0.8906
909 6KT 0.8906
910 PEP 0.8905
911 DS0 0.8904
912 4FH 0.8904
913 IJZ 0.8903
914 YHO 0.8903
915 FUF 0.8902
916 2AF 0.8901
917 B24 0.8901
918 ICB 0.8898
919 9RW 0.8898
920 DHS 0.8896
921 F4E 0.8895
922 9FE 0.8895
923 BNS 0.8895
924 F12 0.8894
925 K17 0.8893
926 1LN 0.8893
927 RBL 0.8892
928 MSR 0.8892
929 AMS 0.8889
930 PXM 0.8889
931 6FZ 0.8887
932 A13 0.8886
933 YIO 0.8886
934 RNS 0.8885
935 FCB 0.8885
936 PYJ 0.8884
937 R8A 0.8884
938 HX2 0.8884
939 NXA 0.8883
940 ILE 0.8882
941 76X 0.8882
942 1DH 0.8882
943 92P 0.8881
944 2RH 0.8880
945 BNF 0.8879
946 GXL 0.8878
947 YTB 0.8878
948 4SD 0.8878
949 TBS 0.8877
950 ASN 0.8877
951 HPY 0.8876
952 GIV 0.8876
953 HA7 0.8875
954 QPR 0.8874
955 PHE 0.8874
956 SR1 0.8872
957 APY 0.8872
958 URQ 0.8871
959 9YL 0.8871
960 C5J 0.8869
961 SS2 0.8869
962 NCT 0.8868
963 KIB 0.8867
964 KIA 0.8867
965 3V4 0.8866
966 SMN 0.8864
967 SJ5 0.8864
968 ICC 0.8864
969 FLA 0.8864
970 1AL 0.8863
971 OHP 0.8863
972 PFB 0.8862
973 COI 0.8861
974 258 0.8861
975 6LW 0.8861
976 ESX 0.8860
977 GCO 0.8860
978 SLS 0.8859
979 FBT 0.8858
980 D1X 0.8857
981 HIU 0.8857
982 FGZ 0.8856
983 CN0 0.8855
984 D07 0.8854
985 RJY 0.8854
986 0F9 0.8852
987 SOR 0.8851
988 8W9 0.8850
989 GCB 0.8850
990 94N 0.8849
991 1XX 0.8847
992 UEG 0.8845
993 CFF 0.8845
994 AMH 0.8844
995 8G0 0.8843
996 6UA 0.8841
997 9KT 0.8839
998 CPZ 0.8839
999 CEJ 0.8838
1000 M0W 0.8837
1001 329 0.8836
1002 GTR 0.8836
1003 7VJ 0.8835
1004 TZF 0.8835
1005 7ME 0.8834
1006 PEY 0.8833
1007 SXS 0.8833
1008 24T 0.8832
1009 E60 0.8831
1010 9ZE 0.8831
1011 TT4 0.8830
1012 E7S 0.8829
1013 Q02 0.8829
1014 AFR 0.8825
1015 HXX 0.8823
1016 MFB 0.8822
1017 2KT 0.8822
1018 DEE 0.8821
1019 JXN 0.8821
1020 X09 0.8820
1021 CLZ 0.8819
1022 YAN 0.8817
1023 ASC 0.8817
1024 BDF 0.8816
1025 ITN 0.8815
1026 KYA 0.8813
1027 SPV 0.8811
1028 TOF 0.8808
1029 1AB 0.8808
1030 KBG 0.8808
1031 3PY 0.8808
1032 GJZ 0.8807
1033 OKG 0.8805
1034 J9N 0.8802
1035 CRN 0.8801
1036 AAE 0.8800
1037 95Z 0.8800
1038 IWT 0.8799
1039 Z5P 0.8796
1040 JZ0 0.8796
1041 FPK 0.8796
1042 DTU 0.8796
1043 ZXD 0.8795
1044 2XX 0.8793
1045 SNU 0.8793
1046 0LH 0.8790
1047 QSH 0.8790
1048 ADA 0.8789
1049 IAC 0.8789
1050 4SX 0.8788
1051 NEQ 0.8788
1052 4XV 0.8786
1053 RPQ 0.8786
1054 L5V 0.8785
1055 12B 0.8783
1056 JUG 0.8781
1057 OA3 0.8780
1058 HFB 0.8779
1059 BR8 0.8779
1060 M0Q 0.8779
1061 680 0.8778
1062 GXE 0.8778
1063 LYL 0.8777
1064 2AS 0.8776
1065 6TZ 0.8776
1066 RNT 0.8775
1067 ZZ3 0.8775
1068 4NB 0.8774
1069 45L 0.8772
1070 SER 0.8772
1071 DSN 0.8772
1072 MRY 0.8771
1073 HAI 0.8771
1074 SVD 0.8770
1075 HYN 0.8768
1076 MBG 0.8768
1077 FDK 0.8767
1078 K8X 0.8766
1079 NVI 0.8763
1080 OGA 0.8763
1081 KG7 0.8761
1082 13X 0.8760
1083 AHB 0.8758
1084 C2Y 0.8757
1085 NK2 0.8757
1086 2FQ 0.8755
1087 G1O 0.8755
1088 QMP 0.8755
1089 1GN 0.8754
1090 R67 0.8753
1091 RD4 0.8753
1092 2TQ 0.8753
1093 5XB 0.8753
1094 FH2 0.8750
1095 M4E 0.8750
1096 ESI 0.8750
1097 XXP 0.8750
1098 PH2 0.8749
1099 39O 0.8748
1100 5CL 0.8748
1101 THR 0.8748
1102 PFL 0.8748
1103 BCF 0.8744
1104 LNR 0.8742
1105 4VY 0.8742
1106 449 0.8742
1107 VOH 0.8741
1108 XLS 0.8740
1109 AX2 0.8740
1110 40E 0.8739
1111 EDR 0.8738
1112 6HQ 0.8738
1113 CEE 0.8737
1114 13P 0.8735
1115 I1N 0.8734
1116 ICF 0.8733
1117 SEP 0.8733
1118 4RU 0.8732
1119 3AY 0.8732
1120 ALO 0.8731
1121 GLF 0.8731
1122 EN1 0.8731
1123 209 0.8729
1124 BBF 0.8728
1125 42J 0.8727
1126 LEU 0.8726
1127 CIT 0.8725
1128 IMR 0.8723
1129 PBE 0.8723
1130 H33 0.8721
1131 NF3 0.8720
1132 TZE 0.8720
1133 0OC 0.8720
1134 SD4 0.8719
1135 JG8 0.8719
1136 IPH 0.8718
1137 LI6 0.8717
1138 G3P 0.8716
1139 G3H 0.8716
1140 ZYR 0.8716
1141 B5D 0.8714
1142 PQK 0.8713
1143 7B3 0.8712
1144 MBN 0.8712
1145 HCS 0.8712
1146 2LY 0.8710
1147 FK8 0.8710
1148 PHH 0.8709
1149 F1A 0.8708
1150 4XS 0.8707
1151 285 0.8707
1152 M3H 0.8707
1153 YSO 0.8705
1154 278 0.8705
1155 DGY 0.8703
1156 2HG 0.8702
1157 27B 0.8702
1158 DPZ 0.8700
1159 428 0.8698
1160 98J 0.8697
1161 GJP 0.8696
1162 5ZE 0.8695
1163 JTH 0.8694
1164 1HN 0.8693
1165 XIX 0.8691
1166 A09 0.8690
1167 N2Z 0.8687
1168 5LA 0.8685
1169 0FK 0.8685
1170 HCI 0.8685
1171 9X6 0.8684
1172 4PW 0.8683
1173 HDA 0.8680
1174 LRH 0.8680
1175 2AP 0.8680
1176 3AP 0.8677
1177 MAJ 0.8676
1178 M4S 0.8675
1179 DQN 0.8675
1180 IBF 0.8675
1181 948 0.8674
1182 2KA 0.8670
1183 2FT 0.8670
1184 GLT 0.8670
1185 2ZX 0.8669
1186 SYG 0.8669
1187 8HC 0.8666
1188 PHT 0.8666
1189 9PO 0.8665
1190 UFV 0.8663
1191 A2Q 0.8663
1192 4P0 0.8662
1193 MSN 0.8659
1194 HRZ 0.8655
1195 K32 0.8653
1196 SNO 0.8652
1197 I3E 0.8652
1198 PEQ 0.8651
1199 WDL 0.8650
1200 4AP 0.8649
1201 12M 0.8648
1202 HHR 0.8648
1203 ACH 0.8648
1204 NTM 0.8647
1205 O7U 0.8647
1206 KPL 0.8646
1207 FBU 0.8646
1208 8CL 0.8645
1209 EV0 0.8644
1210 UNJ 0.8641
1211 FDR 0.8638
1212 0W1 0.8638
1213 0BP 0.8637
1214 HVK 0.8636
1215 SF9 0.8634
1216 PCI 0.8634
1217 F3B 0.8632
1218 TTO 0.8632
1219 BVC 0.8630
1220 OW7 0.8630
1221 ARW 0.8630
1222 OMD 0.8630
1223 Q7A 0.8629
1224 ABA 0.8626
1225 ZVO 0.8625
1226 TWO 0.8624
1227 51F 0.8624
1228 3QV 0.8618
1229 SPA 0.8618
1230 ERH 0.8616
1231 LQ2 0.8614
1232 DA4 0.8614
1233 091 0.8613
1234 BZJ 0.8612
1235 8XL 0.8612
1236 RUU 0.8612
1237 AJY 0.8611
1238 HHN 0.8611
1239 DAS 0.8610
1240 A7H 0.8609
1241 HKD 0.8609
1242 RNO 0.8606
1243 K6X 0.8606
1244 36E 0.8606
1245 II6 0.8604
1246 5AN 0.8603
1247 Q71 0.8602
1248 ONR 0.8601
1249 KLW 0.8598
1250 3AL 0.8596
1251 260 0.8595
1252 SNE 0.8590
1253 ZWZ 0.8590
1254 GZ3 0.8589
1255 RAT 0.8583
1256 LGA 0.8581
1257 PIH 0.8580
1258 M1H 0.8578
1259 BVG 0.8577
1260 2HC 0.8576
1261 K22 0.8574
1262 SEJ 0.8571
1263 GLN 0.8570
1264 7VP 0.8568
1265 GJS 0.8567
1266 M45 0.8566
1267 AN3 0.8566
1268 5NE 0.8564
1269 GGL 0.8564
1270 KTW 0.8552
1271 H7Y 0.8550
1272 KMT 0.8550
1273 4BL 0.8548
1274 2O6 0.8538
1275 HC4 0.8530
1276 TCZ 0.8509
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 2CER; Ligand: PGI; Similar sites found with APoc: 5
This union binding pocket(no: 1) in the query (biounit: 2cer.bio2) has 31 residues
No: Leader PDB Ligand Sequence Similarity
1 4EK7 BGC 40.8998
2 5YIF 8VR 42.5263
3 5YIF 8VR 42.5263
4 5OKG BG6 42.7403
5 4PBG BGP 47.6496
Pocket No.: 2; Query (leader) PDB : 2CER; Ligand: PGI; Similar sites found with APoc: 9
This union binding pocket(no: 2) in the query (biounit: 2cer.bio1) has 31 residues
No: Leader PDB Ligand Sequence Similarity
1 4EK7 BGC 40.8998
2 4EK7 BGC 40.8998
3 5YIF 8VR 42.5263
4 5YIF 8VR 42.5263
5 5OKG BG6 42.7403
6 5OKG BG6 42.7403
7 4JIE BMA 43.3538
8 4PBG BGP 47.6496
9 4PBG BGP 47.6496
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