Receptor
PDB id Resolution Class Description Source Keywords
2VZS 1.85 Å EC: 3.2.1.165 CHITOSAN PRODUCT COMPLEX OF AMYCOLATOPSIS ORIENTALIS EXO-CHI CSXA AMYCOLATOPSIS ORIENTALIS EXO-BETA-D-GLUCOSAMINIDASE HYDROLASE GH2 CSXA GLUCOSAMINGLYCOSIDE HYDROLASE
Ref.: THE STRUCTURAL BASIS OF SUBSTRATE RECOGNITION IN AN EXO-BETA-D-GLUCOSAMINIDASE INVOLVED IN CHITOSAN HYD J.MOL.BIOL. V. 385 131 2009
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
CD A:1899;
A:1900;
A:1901;
B:1899;
B:1900;
B:1901;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
none;
none;
none;
none;
none;
none;
submit data
112.411 Cd [Cd+2...
GCS A:1902;
B:1903;
Valid;
Valid;
none;
none;
submit data
179.171 C6 H13 N O5 C([C@...
GOL A:1903;
B:1902;
B:1904;
Invalid;
Invalid;
Invalid;
none;
none;
none;
submit data
92.094 C3 H8 O3 C(C(C...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
2X05 2.3 Å EC: 3.2.1.165 INHIBITION OF THE EXO-BETA-D-GLUCOSAMINIDASE CSXA BY A GLUCOSAMINE-CONFIGURED CASTANOSPERMINE AND AN AMINO- A USTRALINE ANALOGUE AMYCOLATOPSIS ORIENTALIS EXO-BETA-D-GLUCOSAMINIDASE GLYCOSIDE HYDROLASE GH2 CSXA HYDROLASE GLYCOSIDASE
Ref.: INHIBITION OF THE EXO-BETA-D-GLUCOSAMINIDASE CSXA BY A GLUCOSAMINE-CONFIGURED CASTANOSPERMINE AND AN AMINO-AUSTRALINE ANALOGUE. ORG.BIOMOL.CHEM. V. 7 4169 2009
Members (5)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 2VZU - PNJ C12 H16 N2 O7 c1cc(ccc1[....
2 2VZS - GCS C6 H13 N O5 C([C@@H]1[....
3 2X09 Ki = 175 uM X09 C8 H16 N2 O3 C1C[N@]2[C....
4 2VZT - PNJ C12 H16 N2 O7 c1cc(ccc1[....
5 2X05 Ki = 610 nM X05 C8 H16 N2 O3 C1C[N@@]2C....
70% Homology Family (5)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 2VZU - PNJ C12 H16 N2 O7 c1cc(ccc1[....
2 2VZS - GCS C6 H13 N O5 C([C@@H]1[....
3 2X09 Ki = 175 uM X09 C8 H16 N2 O3 C1C[N@]2[C....
4 2VZT - PNJ C12 H16 N2 O7 c1cc(ccc1[....
5 2X05 Ki = 610 nM X05 C8 H16 N2 O3 C1C[N@@]2C....
50% Homology Family (5)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 2VZU - PNJ C12 H16 N2 O7 c1cc(ccc1[....
2 2VZS - GCS C6 H13 N O5 C([C@@H]1[....
3 2X09 Ki = 175 uM X09 C8 H16 N2 O3 C1C[N@]2[C....
4 2VZT - PNJ C12 H16 N2 O7 c1cc(ccc1[....
5 2X05 Ki = 610 nM X05 C8 H16 N2 O3 C1C[N@@]2C....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: GCS; Similar ligands found: 33
No: Ligand ECFP6 Tc MDL keys Tc
1 PA1 1 1
2 GCS 1 1
3 1GN 1 1
4 X6X 1 1
5 95Z 1 1
6 GLP 0.488372 0.729167
7 4R1 0.488372 0.729167
8 BDR 0.483871 0.684211
9 AHR 0.483871 0.684211
10 FUB 0.483871 0.684211
11 RIB 0.483871 0.684211
12 Z6J 0.483871 0.684211
13 32O 0.483871 0.684211
14 GLA 0.457143 0.777778
15 GAL GAL 0.457143 0.777778
16 GIV 0.457143 0.777778
17 BGC 0.457143 0.777778
18 BGC GAL 0.457143 0.777778
19 GAL 0.457143 0.777778
20 GXL 0.457143 0.777778
21 ALL 0.457143 0.777778
22 WOO 0.457143 0.777778
23 GLC 0.457143 0.777778
24 MAN 0.457143 0.777778
25 GLC GLC 0.457143 0.777778
26 BMA 0.457143 0.777778
27 3LJ 0.454545 0.636364
28 GAF 0.421053 0.7
29 G2F 0.421053 0.7
30 SHG 0.421053 0.7
31 2FG 0.421053 0.7
32 2GS 0.4 0.7
33 GP1 0.4 0.75
Similar Ligands (3D)
Ligand no: 1; Ligand: GCS; Similar ligands found: 1246
No: Ligand Similarity coefficient
1 G3F 1.0000
2 LGC 0.9976
3 KBG 0.9914
4 15L 0.9911
5 82I 0.9888
6 GLT 0.9852
7 CWS 0.9832
8 2D0 0.9821
9 GCB 0.9819
10 PFB 0.9817
11 BDP 0.9814
12 39A 0.9812
13 B57 0.9807
14 8S0 0.9805
15 0P6 0.9800
16 APZ 0.9792
17 25W 0.9791
18 LKA 0.9790
19 DPZ 0.9790
20 GTQ 0.9785
21 KUF 0.9784
22 8CM 0.9783
23 P3K 0.9782
24 KT7 0.9777
25 NOY 0.9774
26 IV2 0.9773
27 5MK 0.9772
28 CWM 0.9763
29 2H5 0.9762
30 5M0 0.9760
31 4XV 0.9758
32 54G 0.9757
33 GCU 0.9756
34 TEP 0.9748
35 NOJ 0.9744
36 ES0 0.9742
37 BCF 0.9741
38 B60 0.9741
39 5RG 0.9740
40 3MG 0.9739
41 SX1 0.9739
42 BBF 0.9735
43 5WX 0.9735
44 4XS 0.9728
45 NDM 0.9727
46 GOX 0.9726
47 GLF 0.9725
48 IBF 0.9723
49 LZM 0.9720
50 YSO 0.9720
51 EVA 0.9719
52 Q88 0.9719
53 XXR 0.9717
54 4AA 0.9711
55 94B 0.9705
56 948 0.9701
57 M1E 0.9701
58 G6D 0.9697
59 ZWZ 0.9693
60 IFL 0.9692
61 MAQ 0.9691
62 9MG 0.9689
63 42A 0.9689
64 GDE 0.9686
65 UNC 0.9677
66 A7W 0.9676
67 LCN 0.9675
68 PXL 0.9675
69 7VS 0.9674
70 KJY 0.9673
71 FOT 0.9670
72 3IT 0.9670
73 ASO 0.9669
74 G5V 0.9668
75 I3A 0.9668
76 EXO 0.9667
77 680 0.9667
78 JIF 0.9663
79 3DO 0.9659
80 HJP 0.9658
81 35C 0.9657
82 23A 0.9656
83 N8Y 0.9655
84 IJZ 0.9654
85 1P7 0.9650
86 F0J 0.9645
87 V55 0.9637
88 7MH 0.9633
89 UAN 0.9633
90 7HQ 0.9632
91 DIN 0.9631
92 MRW 0.9626
93 HFB 0.9625
94 67N 0.9622
95 G1O 0.9622
96 F81 0.9620
97 KIA 0.9618
98 KIB 0.9618
99 C2U 0.9618
100 F3B 0.9617
101 2A7 0.9614
102 FDB 0.9611
103 FYU 0.9611
104 9TZ 0.9609
105 86J 0.9609
106 ADK 0.9609
107 Q6T 0.9608
108 M0Q 0.9608
109 T6C 0.9608
110 3MA 0.9605
111 149 0.9602
112 1WG 0.9600
113 MBG 0.9599
114 12B 0.9599
115 209 0.9598
116 37T 0.9596
117 8H8 0.9595
118 3HA 0.9592
119 JBQ 0.9592
120 DQN 0.9592
121 7VJ 0.9590
122 7B4 0.9590
123 HLZ 0.9590
124 ADZ 0.9590
125 PCI 0.9590
126 H33 0.9590
127 GXY 0.9588
128 SYA 0.9584
129 5WY 0.9578
130 DBH 0.9576
131 0CU 0.9575
132 7W1 0.9574
133 CLZ 0.9574
134 5B1 0.9573
135 YIO 0.9571
136 AKH 0.9571
137 5QX 0.9568
138 03V 0.9567
139 F5B 0.9561
140 PYQ 0.9561
141 FUL 0.9558
142 3F0 0.9555
143 E7Z 0.9551
144 MEW 0.9548
145 6CS 0.9547
146 DHK 0.9547
147 PXM 0.9546
148 JB5 0.9546
149 HMH 0.9545
150 M1A 0.9543
151 3Z7 0.9542
152 MNM 0.9541
153 3M0 0.9541
154 4M4 0.9540
155 ES5 0.9539
156 NID 0.9537
157 MT0 0.9537
158 FGZ 0.9535
159 PE0 0.9534
160 N5J 0.9533
161 JFD 0.9532
162 BTE 0.9532
163 JTH 0.9531
164 XQG 0.9530
165 HZQ 0.9530
166 YH7 0.9529
167 4FS 0.9527
168 2ZQ 0.9524
169 S76 0.9524
170 M1Q 0.9524
171 UEG 0.9522
172 ZB1 0.9522
173 7D2 0.9522
174 XAZ 0.9521
175 5SG 0.9520
176 5XC 0.9520
177 X09 0.9520
178 5IQ 0.9519
179 M0W 0.9518
180 JUG 0.9518
181 MUA 0.9518
182 GUN 0.9518
183 HQY 0.9517
184 HNQ 0.9517
185 3WA 0.9517
186 GCW 0.9516
187 EUG 0.9515
188 HQD 0.9515
189 BP1 0.9512
190 ES1 0.9511
191 1XM 0.9511
192 BTY 0.9511
193 B53 0.9510
194 TC7 0.9509
195 4ZC 0.9508
196 LXC 0.9508
197 5Q0 0.9507
198 JPZ 0.9507
199 JBH 0.9507
200 1NP 0.9505
201 FHN 0.9503
202 4YS 0.9503
203 AZ8 0.9503
204 42C 0.9502
205 NQ 0.9501
206 HX3 0.9500
207 1LM 0.9499
208 VK3 0.9498
209 XAN 0.9498
210 RAM 0.9498
211 7NI 0.9497
212 BEA 0.9497
213 AZ9 0.9497
214 141 0.9497
215 RXA 0.9497
216 3DM 0.9496
217 2AQ 0.9494
218 DBJ 0.9493
219 TBP 0.9493
220 URC 0.9493
221 D07 0.9492
222 ZVO 0.9492
223 DRL 0.9492
224 1SQ 0.9491
225 1LQ 0.9491
226 329 0.9491
227 COU 0.9490
228 TBS 0.9489
229 2HQ 0.9488
230 BOA 0.9488
231 TTY 0.9486
232 FH2 0.9485
233 5NU 0.9485
234 F05 0.9484
235 7ZE 0.9484
236 4HC 0.9484
237 SKA 0.9483
238 Q24 0.9483
239 ISE 0.9483
240 4M0 0.9481
241 SAL 0.9481
242 495 0.9479
243 GRE 0.9479
244 8XQ 0.9478
245 AJV 0.9478
246 PQ0 0.9477
247 INS 0.9476
248 5OB 0.9476
249 DX4 0.9473
250 8WT 0.9473
251 CFF 0.9473
252 O72 0.9472
253 M5K 0.9472
254 BHA 0.9471
255 FA0 0.9470
256 24W 0.9467
257 0RW 0.9467
258 IGA 0.9465
259 DOB 0.9464
260 EJZ 0.9464
261 BCP 0.9464
262 BZX 0.9462
263 9DG 0.9462
264 AZA 0.9461
265 4Z4 0.9460
266 FDK 0.9460
267 6AI 0.9460
268 OCH 0.9460
269 INE 0.9459
270 F4Z 0.9456
271 QSH 0.9456
272 8TX 0.9455
273 BZ3 0.9455
274 J9W 0.9454
275 9KT 0.9453
276 DHB 0.9452
277 1XN 0.9450
278 AQO 0.9450
279 44W 0.9449
280 JBK 0.9449
281 K3Q 0.9449
282 6M1 0.9449
283 SOE 0.9448
284 FE DB1 0.9446
285 7W4 0.9445
286 B55 0.9445
287 XYP 0.9444
288 K17 0.9443
289 75K 0.9442
290 6F0 0.9442
291 9EW 0.9441
292 IFM 0.9440
293 CN0 0.9440
294 6M9 0.9439
295 3Z8 0.9437
296 A2F 0.9436
297 GM7 0.9436
298 GJS 0.9436
299 5JQ 0.9436
300 HLR 0.9435
301 GOO 0.9434
302 TFU 0.9432
303 HKD 0.9432
304 SVN 0.9432
305 ZZT 0.9430
306 6AP 0.9430
307 3R6 0.9430
308 0R0 0.9428
309 H42 0.9428
310 AJ2 0.9427
311 XHP 0.9427
312 5CL 0.9426
313 ICO 0.9426
314 BNT 0.9424
315 DIU 0.9424
316 JAE 0.9424
317 0N7 0.9424
318 QAT 0.9423
319 X05 0.9423
320 3RK 0.9422
321 ISN 0.9421
322 SOR 0.9421
323 226 0.9421
324 LYL 0.9420
325 LI6 0.9418
326 FUC 0.9417
327 SYV 0.9417
328 DGJ 0.9415
329 HH8 0.9415
330 261 0.9414
331 FLV 0.9414
332 5CU 0.9413
333 ES9 0.9413
334 GZ8 0.9413
335 PM6 0.9412
336 AZF 0.9411
337 DFB 0.9407
338 MWP 0.9405
339 4XH 0.9403
340 ADE 0.9402
341 TOF 0.9401
342 5JL 0.9400
343 8IG 0.9400
344 K32 0.9400
345 HQT 0.9399
346 DQU 0.9399
347 290 0.9398
348 AZG 0.9397
349 HHA 0.9397
350 2AK 0.9396
351 QAS 0.9396
352 FCB 0.9395
353 SXS 0.9395
354 7WA 0.9394
355 7HP 0.9393
356 10L 0.9393
357 ABV 0.9393
358 MCT 0.9392
359 11S 0.9392
360 H4N 0.9391
361 DEE 0.9391
362 7WR 0.9389
363 5WV 0.9388
364 OTW 0.9387
365 7CZ 0.9385
366 BK9 0.9385
367 9HX 0.9385
368 QWW 0.9385
369 2CQ 0.9384
370 4JJ 0.9380
371 G4D 0.9380
372 MFU 0.9379
373 9DA 0.9379
374 5MI 0.9379
375 CTS 0.9378
376 6GU 0.9377
377 3CE 0.9377
378 5MB 0.9376
379 FK1 0.9374
380 QOS 0.9373
381 14O 0.9373
382 GOG 0.9372
383 06B 0.9372
384 QPR 0.9371
385 BE2 0.9371
386 4MU 0.9369
387 AFR 0.9369
388 ARB 0.9368
389 NTZ 0.9367
390 JZ3 0.9367
391 GTR 0.9366
392 93K 0.9365
393 XQ0 0.9362
394 KKN 0.9362
395 MO8 0.9362
396 UQ 0.9361
397 SWD 0.9361
398 JND 0.9359
399 OXZ 0.9358
400 45C 0.9357
401 MFB 0.9357
402 2ZV 0.9357
403 UFO 0.9357
404 9PY 0.9357
405 XYS 0.9357
406 BSX 0.9356
407 FUF 0.9356
408 SKM 0.9354
409 5H1 0.9353
410 HH5 0.9353
411 HPA 0.9353
412 5NE 0.9350
413 F60 0.9348
414 ES4 0.9347
415 2EC 0.9346
416 EMZ 0.9346
417 ES7 0.9346
418 2MN 0.9346
419 R8V 0.9345
420 AMG 0.9345
421 CFP 0.9344
422 8W9 0.9342
423 4HO 0.9341
424 TM4 0.9341
425 RM4 0.9340
426 KGK 0.9340
427 2CM 0.9340
428 4HM 0.9338
429 5RN 0.9337
430 F9Y 0.9334
431 DIE 0.9332
432 EV0 0.9330
433 EYK 0.9330
434 K22 0.9329
435 PYD 0.9328
436 PSV 0.9327
437 EQT 0.9326
438 ORO 0.9326
439 SRO 0.9325
440 HMU 0.9324
441 MBD 0.9324
442 D3M 0.9324
443 INO 0.9324
444 GMN 0.9323
445 DUB 0.9322
446 4CL 0.9321
447 XBZ 0.9320
448 4NC 0.9320
449 27Y 0.9319
450 6MH 0.9319
451 3XX 0.9318
452 2HO 0.9317
453 MSN 0.9315
454 GIO 0.9315
455 MWJ 0.9312
456 MZG 0.9311
457 SWA 0.9309
458 DMJ 0.9308
459 ES6 0.9308
460 0TR 0.9307
461 URF 0.9307
462 2LP 0.9307
463 2K4 0.9307
464 YQA 0.9306
465 A1U 0.9305
466 PHH 0.9305
467 ZZ3 0.9305
468 XYD 0.9304
469 JZ2 0.9303
470 P9P 0.9303
471 PRF 0.9302
472 VNL 0.9302
473 NK 0.9301
474 2MY 0.9301
475 I1N 0.9301
476 275 0.9300
477 6MP 0.9299
478 AS3 0.9299
479 FP1 0.9299
480 2MI 0.9299
481 P92 0.9299
482 1MC 0.9297
483 JKE 0.9297
484 VOH 0.9296
485 RNS 0.9295
486 GYP 0.9294
487 32X 0.9294
488 KOJ 0.9294
489 BR9 0.9294
490 5JC 0.9294
491 PYG 0.9293
492 MVN 0.9293
493 DNF 0.9293
494 4ZE 0.9292
495 MYJ 0.9292
496 92K 0.9291
497 QBK 0.9290
498 2AC 0.9288
499 6ME 0.9288
500 TTL 0.9288
501 2C9 0.9287
502 SHA 0.9285
503 270 0.9284
504 AX7 0.9284
505 2YU 0.9283
506 5RO 0.9281
507 2A9 0.9280
508 OXC 0.9280
509 KJH 0.9278
510 CHB 0.9278
511 94N 0.9278
512 B62 0.9276
513 260 0.9275
514 ICP 0.9275
515 8NY 0.9275
516 MT5 0.9274
517 L7T 0.9274
518 34A 0.9274
519 M2K 0.9273
520 34D 0.9273
521 RM1 0.9272
522 HBA 0.9272
523 PH2 0.9271
524 EA1 0.9270
525 3U4 0.9270
526 QX4 0.9270
527 36R 0.9269
528 7B3 0.9269
529 23J 0.9268
530 57O 0.9268
531 0W8 0.9263
532 GT0 0.9263
533 4ME 0.9263
534 FLM 0.9261
535 PRZ 0.9261
536 CLW 0.9261
537 GCV 0.9259
538 OA3 0.9258
539 K2T 0.9258
540 AW5 0.9256
541 HXX 0.9256
542 1P8 0.9255
543 12Q 0.9254
544 HHR 0.9254
545 GTL 0.9253
546 3MB 0.9253
547 43M 0.9252
548 24B 0.9251
549 DBX 0.9251
550 FFP 0.9251
551 BDF 0.9250
552 M1H 0.9250
553 FBB 0.9249
554 MVL 0.9249
555 NMJ 0.9248
556 3FA 0.9247
557 MQN 0.9246
558 N2I 0.9246
559 TDR 0.9244
560 4XR 0.9244
561 RPQ 0.9243
562 MWM 0.9243
563 DMD 0.9242
564 JYB 0.9241
565 D1X 0.9241
566 2MP 0.9240
567 ET2 0.9239
568 AEZ 0.9238
569 3MH 0.9238
570 QSB 0.9238
571 WBU 0.9237
572 NSP 0.9237
573 SJ5 0.9237
574 0FO 0.9236
575 KDV 0.9236
576 4JQ 0.9235
577 ASC 0.9234
578 8ZE 0.9234
579 OVM 0.9233
580 2KA 0.9232
581 2BG 0.9232
582 3MC 0.9229
583 ES2 0.9228
584 1DW 0.9227
585 0MK 0.9227
586 UFV 0.9227
587 5VM 0.9226
588 GIM 0.9226
589 ZZ8 0.9224
590 150 0.9223
591 FHB 0.9223
592 TH7 0.9222
593 DHQ 0.9222
594 4SV 0.9221
595 8HC 0.9221
596 HT4 0.9220
597 HTP 0.9219
598 GYE 0.9219
599 4A3 0.9218
600 JBE 0.9217
601 XX2 0.9216
602 F1A 0.9216
603 IF7 0.9214
604 MHK 0.9212
605 2ZX 0.9212
606 F12 0.9212
607 MR1 0.9211
608 4JO 0.9211
609 286 0.9211
610 5MH 0.9210
611 4YO 0.9210
612 LSA 0.9209
613 XIY 0.9208
614 KBB 0.9207
615 Y8I 0.9206
616 H6B 0.9203
617 0TU 0.9203
618 SFU 0.9202
619 NNO 0.9201
620 3HM 0.9201
621 JXN 0.9200
622 KJU 0.9200
623 ESI 0.9200
624 0LH 0.9197
625 6HQ 0.9197
626 2LY 0.9196
627 9TW 0.9195
628 MS9 0.9194
629 FCA 0.9193
630 KFH 0.9192
631 ADA 0.9192
632 TH0 0.9191
633 IHB 0.9191
634 FRU 0.9190
635 3NT 0.9189
636 44V 0.9189
637 6UA 0.9189
638 JLZ 0.9189
639 DOR 0.9189
640 3AB 0.9188
641 0FK 0.9188
642 MMA 0.9185
643 1WD 0.9185
644 C2Y 0.9185
645 IUR 0.9183
646 NPY 0.9182
647 6M4 0.9181
648 TM7 0.9181
649 4JT 0.9179
650 VGD 0.9179
651 NTM 0.9178
652 R8A 0.9177
653 EOL 0.9176
654 MIG 0.9175
655 GAB 0.9175
656 LT2 0.9173
657 WCE 0.9173
658 8GC 0.9172
659 MA3 0.9171
660 5UC 0.9170
661 GTZ 0.9170
662 B0D 0.9170
663 QUZ 0.9170
664 OVV 0.9169
665 6VD 0.9168
666 3HB 0.9168
667 2FQ 0.9168
668 R9Y 0.9167
669 PHB 0.9167
670 3RI 0.9163
671 KYA 0.9162
672 DQA 0.9161
673 BR8 0.9159
674 M6N 0.9159
675 LDP 0.9158
676 5HN 0.9157
677 DNA 0.9154
678 K5W 0.9153
679 5AN 0.9152
680 KP6 0.9151
681 3SK 0.9150
682 293 0.9150
683 3BZ 0.9149
684 5WU 0.9148
685 ERH 0.9146
686 II6 0.9145
687 GZL 0.9145
688 5ZE 0.9144
689 KLW 0.9142
690 0FN 0.9142
691 12M 0.9141
692 PBR 0.9141
693 BRT 0.9141
694 39O 0.9140
695 TWO 0.9140
696 9KH 0.9140
697 DIG 0.9138
698 1X7 0.9136
699 FBT 0.9136
700 JU2 0.9134
701 1M2 0.9134
702 8GK 0.9133
703 H5B 0.9133
704 JA8 0.9133
705 TSS 0.9131
706 2CK 0.9131
707 GBD 0.9131
708 7WV 0.9130
709 MZB 0.9129
710 NVU 0.9129
711 94W 0.9129
712 PDC 0.9128
713 IPB 0.9127
714 OW4 0.9127
715 DNC 0.9127
716 3PF 0.9127
717 PHT 0.9126
718 VNJ 0.9124
719 AX2 0.9124
720 GV9 0.9123
721 AIN 0.9122
722 BCU 0.9121
723 K6X 0.9119
724 4TU 0.9117
725 4KL 0.9117
726 CWJ 0.9116
727 NGO 0.9114
728 IPZ 0.9113
729 0HO 0.9113
730 1U6 0.9111
731 H7Y 0.9110
732 BHO 0.9110
733 13X 0.9109
734 3AY 0.9109
735 QWN 0.9108
736 2AL 0.9105
737 FA3 0.9104
738 AGK 0.9103
739 TLD 0.9101
740 WDL 0.9100
741 AJY 0.9098
742 CTL 0.9097
743 8WO 0.9097
744 NDH 0.9096
745 KYD 0.9093
746 JXZ 0.9090
747 2FY 0.9090
748 AEH 0.9089
749 YTB 0.9089
750 Z5P 0.9088
751 3ID 0.9085
752 X8D 0.9085
753 2XX 0.9084
754 JXW 0.9083
755 GIF 0.9079
756 RUU 0.9078
757 5GU 0.9077
758 PAV 0.9076
759 97T 0.9075
760 L3Q 0.9071
761 O2A 0.9071
762 3DY 0.9071
763 G3E 0.9070
764 RIP 0.9068
765 I6G 0.9068
766 6LW 0.9067
767 HA7 0.9067
768 5NS 0.9067
769 FDR 0.9066
770 3NY 0.9065
771 64K 0.9065
772 ARA 0.9065
773 DFU 0.9064
774 ODO 0.9064
775 JKZ 0.9063
776 TCZ 0.9062
777 7ME 0.9062
778 53C 0.9062
779 FBG 0.9061
780 4VP 0.9061
781 1KP 0.9060
782 0JD 0.9058
783 C9E 0.9057
784 92P 0.9057
785 CGB 0.9056
786 ZXD 0.9055
787 LZ2 0.9053
788 JZ1 0.9052
789 CBF 0.9051
790 3A9 0.9051
791 NGT 0.9050
792 H62 0.9046
793 J9Q 0.9046
794 3CU 0.9045
795 HA5 0.9043
796 ZYR 0.9042
797 6KX 0.9041
798 1U1 0.9041
799 XYL 0.9041
800 HPT 0.9039
801 0HN 0.9039
802 6BL 0.9039
803 APS 0.9038
804 9FE 0.9038
805 FSW 0.9036
806 2CZ 0.9033
807 6XI 0.9033
808 3C2 0.9030
809 SE2 0.9030
810 18N 0.9028
811 TSR 0.9027
812 6RQ 0.9026
813 DHR 0.9025
814 9ZE 0.9024
815 3FH 0.9023
816 5DI 0.9021
817 F31 0.9021
818 TVP 0.9020
819 39U 0.9020
820 AX3 0.9019
821 9FL 0.9019
822 LNR 0.9018
823 1LN 0.9018
824 PRY 0.9017
825 NGW 0.9016
826 TGX 0.9016
827 42J 0.9015
828 ZZZ 0.9014
829 3GQ 0.9013
830 2CL 0.9013
831 CKX 0.9011
832 NEQ 0.9007
833 JAW 0.9007
834 JFJ 0.9006
835 Q7A 0.9004
836 KTW 0.9003
837 NIZ 0.9003
838 PAB 0.9003
839 IDH 0.9002
840 AY4 0.9002
841 NPO 0.9002
842 PZI 0.9002
843 J5I 0.9000
844 ARW 0.8995
845 KJ5 0.8995
846 6NT 0.8995
847 091 0.8991
848 OXQ 0.8991
849 H8N 0.8991
850 TNE 0.8991
851 D48 0.8990
852 OW7 0.8989
853 AH8 0.8989
854 EKZ 0.8987
855 4RU 0.8987
856 R8S 0.8986
857 SF9 0.8986
858 FX1 0.8985
859 4JM 0.8985
860 RAT 0.8984
861 VXX 0.8984
862 3C1 0.8983
863 9R5 0.8983
864 IFP 0.8983
865 ISZ 0.8982
866 1F1 0.8981
867 OMD 0.8980
868 DEN 0.8979
869 AUD 0.8979
870 GJP 0.8978
871 7MX 0.8978
872 SF6 0.8978
873 5QY 0.8978
874 ABE 0.8977
875 REL 0.8977
876 DHS 0.8976
877 GVH 0.8975
878 28N 0.8975
879 5AC 0.8974
880 0R1 0.8974
881 PTO 0.8974
882 FBM 0.8973
883 ARP 0.8972
884 IND 0.8971
885 2ZM 0.8969
886 2HU 0.8967
887 IP0 0.8966
888 0F9 0.8966
889 H76 0.8965
890 BZI 0.8964
891 1AB 0.8962
892 LZ1 0.8960
893 BZF 0.8960
894 A13 0.8959
895 LDR 0.8959
896 AC6 0.8959
897 FAN 0.8958
898 FBV 0.8957
899 12T 0.8957
900 X0V 0.8956
901 ABI 0.8956
902 FXH 0.8955
903 GAG 0.8955
904 15N 0.8955
905 XUL 0.8954
906 NLA 0.8954
907 0CT 0.8954
908 TAR 0.8952
909 K37 0.8951
910 FUD 0.8949
911 MPI 0.8948
912 1QP 0.8948
913 N7I 0.8948
914 BEZ 0.8947
915 CFI 0.8946
916 NCA 0.8946
917 34V 0.8944
918 XM0 0.8942
919 FBU 0.8941
920 B2J 0.8939
921 IDM 0.8937
922 QIC 0.8936
923 TRA 0.8935
924 SVD 0.8935
925 V6F 0.8934
926 6X8 0.8933
927 3TJ 0.8933
928 9AP 0.8932
929 1PT 0.8932
930 2CH 0.8931
931 EGR 0.8931
932 61M 0.8928
933 1HN 0.8927
934 27B 0.8927
935 V1T 0.8927
936 PEY 0.8924
937 6NI 0.8923
938 J9T 0.8921
939 QM1 0.8919
940 GLG 0.8918
941 QXW 0.8917
942 OVP 0.8917
943 R2B 0.8917
944 GLY PRO 0.8916
945 HTS 0.8915
946 SYR 0.8915
947 TLA 0.8914
948 IBM 0.8913
949 FB1 0.8913
950 B5D 0.8912
951 5NI 0.8912
952 60Q 0.8911
953 DHY 0.8910
954 FA6 0.8909
955 Q77 0.8909
956 A29 0.8908
957 HHS 0.8906
958 6R8 0.8904
959 M3S 0.8902
960 R9S 0.8902
961 N3W 0.8902
962 52C 0.8902
963 4MA 0.8901
964 LRH 0.8901
965 HDH 0.8900
966 3R9 0.8899
967 7I2 0.8896
968 JZ4 0.8895
969 BEW 0.8895
970 1Y6 0.8895
971 MJ2 0.8894
972 G12 0.8894
973 68A 0.8894
974 HBO 0.8894
975 YRL 0.8890
976 0W1 0.8890
977 ESP 0.8890
978 60P 0.8890
979 ONR 0.8890
980 BEN 0.8890
981 NBG 0.8889
982 826 0.8889
983 HBD 0.8889
984 CAQ 0.8888
985 M5N 0.8887
986 20J 0.8885
987 PBZ 0.8884
988 XX3 0.8882
989 KG1 0.8880
990 1KH 0.8879
991 QX2 0.8878
992 717 0.8877
993 4CS 0.8877
994 SW7 0.8877
995 PD2 0.8876
996 L99 0.8874
997 NBZ 0.8874
998 3OC 0.8873
999 PX7 0.8873
1000 XQK 0.8873
1001 4FH 0.8872
1002 EDG 0.8872
1003 JDN 0.8871
1004 PZM 0.8871
1005 SYG 0.8869
1006 XXP 0.8867
1007 HIO 0.8867
1008 M4E 0.8866
1009 ICT 0.8865
1010 RB5 0.8864
1011 SEJ 0.8864
1012 173 0.8863
1013 SR1 0.8861
1014 4SX 0.8861
1015 GCO 0.8860
1016 SVJ 0.8858
1017 Z82 0.8857
1018 1U5 0.8851
1019 ROR 0.8850
1020 4P5 0.8850
1021 NAG 0.8849
1022 CRS 0.8849
1023 8VN 0.8847
1024 PZA 0.8847
1025 MLT 0.8846
1026 URA 0.8846
1027 EPR 0.8845
1028 SRT 0.8845
1029 KIF 0.8844
1030 1AL 0.8843
1031 BAM 0.8842
1032 IPM 0.8841
1033 Q71 0.8840
1034 JZ9 0.8839
1035 TMH 0.8837
1036 NIO 0.8836
1037 LFR 0.8835
1038 GLO 0.8834
1039 PFL 0.8832
1040 FPY 0.8832
1041 41K 0.8832
1042 0XT 0.8831
1043 4PW 0.8831
1044 505 0.8830
1045 PQK 0.8830
1046 PBE 0.8830
1047 SYN 0.8829
1048 T9G 0.8829
1049 OAA 0.8826
1050 UNU 0.8824
1051 HLD 0.8823
1052 5OF 0.8822
1053 FA1 0.8821
1054 N7P 0.8820
1055 DZX 0.8819
1056 4VS 0.8818
1057 ANN 0.8818
1058 NOK 0.8817
1059 BZ2 0.8816
1060 P84 0.8813
1061 5FN 0.8813
1062 GDL 0.8812
1063 MXN 0.8811
1064 2TQ 0.8810
1065 RXR 0.8810
1066 OFQ 0.8806
1067 PAF 0.8806
1068 KPL 0.8804
1069 BML 0.8804
1070 6PC 0.8804
1071 0GZ 0.8803
1072 E3D 0.8802
1073 URQ 0.8802
1074 HBX 0.8801
1075 NCD 0.8799
1076 OHP 0.8798
1077 CAM 0.8798
1078 K97 0.8795
1079 45L 0.8794
1080 15E 0.8794
1081 LDU 0.8792
1082 1XX 0.8792
1083 N2Z 0.8791
1084 JB8 0.8791
1085 RHU 0.8789
1086 LMR 0.8789
1087 26D 0.8787
1088 RMN 0.8786
1089 YHO 0.8785
1090 ENL 0.8783
1091 PBC 0.8783
1092 QSC 0.8783
1093 HDL 0.8781
1094 HGQ 0.8780
1095 RJY 0.8777
1096 7N0 0.8777
1097 8OZ 0.8776
1098 LAO 0.8774
1099 I3C 0.8774
1100 TT4 0.8774
1101 XCZ 0.8773
1102 BRV 0.8771
1103 5HY 0.8769
1104 BPU 0.8769
1105 4RW 0.8768
1106 C2A 0.8768
1107 4NG 0.8765
1108 JR2 0.8765
1109 1P3 0.8765
1110 E7R 0.8764
1111 TAG 0.8763
1112 51R 0.8763
1113 8NX 0.8763
1114 CNL 0.8763
1115 FPK 0.8762
1116 2D3 0.8762
1117 NDG 0.8761
1118 9CA 0.8761
1119 ICB 0.8760
1120 RD4 0.8759
1121 BZJ 0.8759
1122 M6Z 0.8758
1123 IPT 0.8758
1124 8VE 0.8757
1125 VC2 0.8756
1126 PHE 0.8756
1127 RBL 0.8754
1128 IMR 0.8754
1129 069 0.8754
1130 PNZ 0.8754
1131 NK2 0.8752
1132 ESX 0.8752
1133 GSY 0.8750
1134 4JL 0.8750
1135 IAC 0.8748
1136 6HP 0.8748
1137 MXX 0.8746
1138 HIS 0.8746
1139 2K8 0.8744
1140 4CH 0.8742
1141 HHT 0.8740
1142 MQB 0.8739
1143 64C 0.8739
1144 FLC 0.8739
1145 TYL 0.8739
1146 CIP 0.8736
1147 R1X 0.8736
1148 3AL 0.8735
1149 6KT 0.8734
1150 3C7 0.8733
1151 6FZ 0.8727
1152 HQJ 0.8727
1153 KTA 0.8726
1154 F9P 0.8726
1155 JG8 0.8725
1156 1IT 0.8723
1157 GC2 0.8722
1158 2SX 0.8720
1159 JF1 0.8720
1160 CAH 0.8720
1161 6X9 0.8714
1162 PKU 0.8711
1163 FBA 0.8709
1164 N8P 0.8709
1165 DX3 0.8709
1166 J6W 0.8705
1167 PBA 0.8704
1168 67X 0.8701
1169 4ZA 0.8699
1170 L5V 0.8699
1171 PHU 0.8695
1172 C2B 0.8689
1173 CKU 0.8688
1174 LIP 0.8687
1175 9RW 0.8687
1176 4WL 0.8687
1177 GLU 0.8685
1178 1A7 0.8684
1179 BNF 0.8684
1180 CAX 0.8683
1181 RSF 0.8680
1182 X0W 0.8679
1183 JF2 0.8676
1184 E5X 0.8676
1185 EU7 0.8676
1186 RIM 0.8675
1187 2DR 0.8675
1188 CKA 0.8674
1189 4FA 0.8674
1190 J01 0.8673
1191 TZE 0.8671
1192 14J 0.8671
1193 TQU 0.8668
1194 NTN 0.8665
1195 1MR 0.8660
1196 URP 0.8659
1197 ADO 0.8658
1198 HY1 0.8654
1199 E35 0.8654
1200 CXF 0.8651
1201 SMN 0.8648
1202 XXG 0.8647
1203 CIT 0.8641
1204 OTD 0.8640
1205 AEF 0.8640
1206 23W 0.8638
1207 FQI 0.8636
1208 M3Q 0.8635
1209 ASN 0.8633
1210 HY3 0.8632
1211 TSU 0.8630
1212 2PG 0.8626
1213 CRN 0.8626
1214 4V6 0.8622
1215 DVG 0.8621
1216 RSO 0.8618
1217 P72 0.8617
1218 9YT 0.8616
1219 SNE 0.8612
1220 5LA 0.8607
1221 ABN 0.8603
1222 3ZQ 0.8599
1223 SLC 0.8597
1224 GL1 0.8595
1225 RP7 0.8595
1226 YCP 0.8591
1227 EDR 0.8591
1228 FCR 0.8589
1229 40O 0.8585
1230 G1P 0.8583
1231 0RN 0.8582
1232 PEP 0.8579
1233 ASP 0.8578
1234 SIF 0.8572
1235 4BY 0.8568
1236 PCA 0.8566
1237 GZQ 0.8562
1238 AI2 0.8562
1239 8TW 0.8559
1240 3BU 0.8553
1241 IT2 0.8537
1242 ITN 0.8529
1243 SAN 0.8525
1244 RBJ 0.8513
1245 CH9 0.8507
1246 AMC 0.8503
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 2X05; Ligand: X05; 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: 2x05.bio2) has 17 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 2X05; Ligand: X05; 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: 2x05.bio1) has 18 residues
No: Leader PDB Ligand Sequence Similarity
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