Receptor
PDB id Resolution Class Description Source Keywords
4WS4 1.18 Å EC: 3.2.2.27 CRYSTAL STRUCTURE OF MYCOBACTERIUM TUBERCULOSIS URACIL-DNA G IN COMPLEX WITH 5-NITROURACIL, FORM I MYCOBACTERIUM TUBERCULOSIS DNA-REPAIR EXCISION REPAIR CONFORMATIONAL SELECTION LIGANBINDING HYDROLASE
Ref.: STRUCTURAL PLASTICITY IN MYCOBACTERIUM TUBERCULOSIS URACIL-DNA GLYCOSYLASE (MTUNG) AND ITS FUNCTIONAL IMPLICATIONS. ACTA CRYSTALLOGR.,SECT.D V. 71 1514 2015
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
DMS A:308;
A:306;
A:307;
A:305;
Invalid;
Invalid;
Invalid;
Invalid;
none;
none;
none;
none;
submit data
78.133 C2 H6 O S CS(=O...
5NU A:303;
Valid;
none;
submit data
157.084 C4 H3 N3 O4 C1=C(...
CIT A:302;
A:301;
Invalid;
Invalid;
none;
none;
submit data
192.124 C6 H8 O7 C(C(=...
CL A:309;
A:310;
Invalid;
Invalid;
none;
none;
submit data
35.453 Cl [Cl-]
IPA A:304;
Invalid;
none;
submit data
60.095 C3 H8 O CC(C)...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
4WS6 1.1 Å EC: 3.2.2.27 CRYSTAL STRUCTURE OF MYCOBACTERIUM TUBERCULOSIS URACIL-DNA G IN COMPLEX WITH 5-AMINOURACIL, FORM I MYCOBACTERIUM TUBERCULOSIS DNA-REPAIR EXCISION REPAIR CONFORMATIONAL SELECTION LIGANBINDING HYDROLASE
Ref.: STRUCTURAL PLASTICITY IN MYCOBACTERIUM TUBERCULOSIS URACIL-DNA GLYCOSYLASE (MTUNG) AND ITS FUNCTIONAL IMPLICATIONS. ACTA CRYSTALLOGR.,SECT.D V. 71 1514 2015
Members (15)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 4 families.
1 4WRV - URA C4 H4 N2 O2 C1=CNC(=O)....
2 4WS5 - 5NU C4 H3 N3 O4 C1=C(C(=O)....
3 4WS8 - TUL C4 H4 N2 O S C1=CNC(=S)....
4 3A7N - FLC C6 H5 O7 C(C(=O)[O-....
5 4WS6 - WBU C4 H5 N3 O2 C1=C(C(=O)....
6 4WS2 - 6UA C4 H5 N3 O2 C1C(=NC(=O....
7 4WS0 - URF C4 H3 F N2 O2 C1=C(C(=O)....
8 4WS7 - 5UC C4 H3 Cl N2 O2 C1=C(C(=O)....
9 4WRU - URA C4 H4 N2 O2 C1=CNC(=O)....
10 4WS1 - URF C4 H3 F N2 O2 C1=C(C(=O)....
11 4WS4 - 5NU C4 H3 N3 O4 C1=C(C(=O)....
12 4WS3 - 6UA C4 H5 N3 O2 C1C(=NC(=O....
13 4WRY - URF C4 H3 F N2 O2 C1=C(C(=O)....
14 4WPL - URA C4 H4 N2 O2 C1=CNC(=O)....
15 4WRZ - URF C4 H3 F N2 O2 C1=C(C(=O)....
70% Homology Family (15)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 4 families.
1 4WRV - URA C4 H4 N2 O2 C1=CNC(=O)....
2 4WS5 - 5NU C4 H3 N3 O4 C1=C(C(=O)....
3 4WS8 - TUL C4 H4 N2 O S C1=CNC(=S)....
4 3A7N - FLC C6 H5 O7 C(C(=O)[O-....
5 4WS6 - WBU C4 H5 N3 O2 C1=C(C(=O)....
6 4WS2 - 6UA C4 H5 N3 O2 C1C(=NC(=O....
7 4WS0 - URF C4 H3 F N2 O2 C1=C(C(=O)....
8 4WS7 - 5UC C4 H3 Cl N2 O2 C1=C(C(=O)....
9 4WRU - URA C4 H4 N2 O2 C1=CNC(=O)....
10 4WS1 - URF C4 H3 F N2 O2 C1=C(C(=O)....
11 4WS4 - 5NU C4 H3 N3 O4 C1=C(C(=O)....
12 4WS3 - 6UA C4 H5 N3 O2 C1C(=NC(=O....
13 4WRY - URF C4 H3 F N2 O2 C1=C(C(=O)....
14 4WPL - URA C4 H4 N2 O2 C1=CNC(=O)....
15 4WRZ - URF C4 H3 F N2 O2 C1=C(C(=O)....
50% Homology Family (15)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 3 families.
1 4WRV - URA C4 H4 N2 O2 C1=CNC(=O)....
2 4WS5 - 5NU C4 H3 N3 O4 C1=C(C(=O)....
3 4WS8 - TUL C4 H4 N2 O S C1=CNC(=S)....
4 3A7N - FLC C6 H5 O7 C(C(=O)[O-....
5 4WS6 - WBU C4 H5 N3 O2 C1=C(C(=O)....
6 4WS2 - 6UA C4 H5 N3 O2 C1C(=NC(=O....
7 4WS0 - URF C4 H3 F N2 O2 C1=C(C(=O)....
8 4WS7 - 5UC C4 H3 Cl N2 O2 C1=C(C(=O)....
9 4WRU - URA C4 H4 N2 O2 C1=CNC(=O)....
10 4WS1 - URF C4 H3 F N2 O2 C1=C(C(=O)....
11 4WS4 - 5NU C4 H3 N3 O4 C1=C(C(=O)....
12 4WS3 - 6UA C4 H5 N3 O2 C1C(=NC(=O....
13 4WRY - URF C4 H3 F N2 O2 C1=C(C(=O)....
14 4WPL - URA C4 H4 N2 O2 C1=CNC(=O)....
15 4WRZ - URF C4 H3 F N2 O2 C1=C(C(=O)....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: 5NU; Similar ligands found: 5
No: Ligand ECFP6 Tc MDL keys Tc
1 5NU 1 1
2 URF 0.441176 0.649123
3 IUR 0.428571 0.649123
4 5UC 0.428571 0.649123
5 WBU 0.4 0.727273
Similar Ligands (3D)
Ligand no: 1; Ligand: 5NU; Similar ligands found: 1413
No: Ligand Similarity coefficient
1 FA0 1.0000
2 5CU 1.0000
3 4M0 0.9991
4 DOB 0.9977
5 BHA 0.9955
6 IPB 0.9872
7 BGC 0.9823
8 SAL 0.9817
9 BE2 0.9789
10 ES6 0.9785
11 3U4 0.9762
12 NPO 0.9760
13 PHB 0.9760
14 4SV 0.9746
15 FYU 0.9745
16 PAB 0.9736
17 HMU 0.9717
18 HBD 0.9709
19 NOJ 0.9702
20 HMH 0.9701
21 B57 0.9689
22 VNJ 0.9684
23 JBE 0.9681
24 1Y6 0.9676
25 2FY 0.9664
26 XQ0 0.9656
27 GLC 0.9650
28 PBZ 0.9649
29 5RN 0.9648
30 A7W 0.9640
31 4MA 0.9637
32 ODO 0.9627
33 826 0.9624
34 9DG 0.9623
35 8H8 0.9617
36 1WD 0.9617
37 M1A 0.9613
38 ES5 0.9611
39 COU 0.9608
40 5OB 0.9608
41 DIN 0.9606
42 24B 0.9605
43 BZX 0.9603
44 03V 0.9602
45 ZZT 0.9600
46 174 0.9600
47 H42 0.9596
48 67N 0.9589
49 XAN 0.9589
50 GRE 0.9589
51 URC 0.9589
52 A2F 0.9588
53 TIU 0.9588
54 7WV 0.9587
55 CN0 0.9586
56 Z82 0.9584
57 14O 0.9581
58 4AA 0.9580
59 MS9 0.9579
60 GUN 0.9579
61 JKE 0.9575
62 AZA 0.9573
63 6M9 0.9571
64 TTL 0.9571
65 141 0.9571
66 MRW 0.9569
67 4FS 0.9564
68 6AP 0.9564
69 3PF 0.9564
70 ET2 0.9563
71 I3A 0.9562
72 EA1 0.9560
73 P72 0.9559
74 GTQ 0.9559
75 6AI 0.9558
76 6F0 0.9557
77 JAE 0.9557
78 8TX 0.9557
79 2AQ 0.9554
80 6M1 0.9552
81 F60 0.9551
82 AX7 0.9550
83 AC6 0.9547
84 ASO 0.9547
85 OCH 0.9545
86 BZ3 0.9544
87 TH7 0.9540
88 E7Z 0.9540
89 R8V 0.9540
90 5H1 0.9539
91 QBK 0.9537
92 SVN 0.9536
93 9EW 0.9534
94 7B4 0.9533
95 JB5 0.9533
96 ABV 0.9531
97 12Q 0.9530
98 PXL 0.9529
99 86J 0.9528
100 RM1 0.9528
101 5WV 0.9526
102 SW7 0.9526
103 2K4 0.9526
104 5MB 0.9526
105 SHA 0.9525
106 0RW 0.9522
107 4NC 0.9522
108 270 0.9522
109 11S 0.9520
110 NNO 0.9518
111 BTY 0.9518
112 NSP 0.9518
113 ICO 0.9518
114 5MI 0.9515
115 G2F 0.9513
116 HLR 0.9512
117 1SQ 0.9511
118 B55 0.9510
119 1LQ 0.9509
120 IFL 0.9506
121 0P6 0.9506
122 IGA 0.9506
123 ADZ 0.9504
124 LCN 0.9503
125 NOY 0.9500
126 AZG 0.9500
127 XAZ 0.9500
128 7W1 0.9499
129 FDB 0.9498
130 HBA 0.9498
131 6NT 0.9498
132 G3F 0.9497
133 3F0 0.9497
134 N5J 0.9496
135 AZ8 0.9495
136 FBB 0.9495
137 KJH 0.9493
138 XM0 0.9493
139 F05 0.9492
140 3ID 0.9492
141 SYV 0.9492
142 3DO 0.9492
143 1XM 0.9492
144 5RG 0.9491
145 4Z4 0.9491
146 M2K 0.9491
147 5JQ 0.9490
148 4JT 0.9488
149 KKN 0.9487
150 VGD 0.9486
151 0CU 0.9486
152 7HQ 0.9485
153 AHR 0.9485
154 GCS 0.9485
155 5QX 0.9483
156 E5X 0.9482
157 MEW 0.9480
158 5SG 0.9479
159 DHB 0.9477
160 2EC 0.9477
161 Q24 0.9474
162 5IQ 0.9473
163 2MI 0.9473
164 KT7 0.9473
165 1NP 0.9470
166 P92 0.9469
167 DMD 0.9468
168 ES9 0.9468
169 ES7 0.9467
170 6M4 0.9466
171 JPZ 0.9466
172 SWA 0.9466
173 ES1 0.9465
174 YH7 0.9464
175 GCU 0.9464
176 1LM 0.9463
177 75K 0.9463
178 HHA 0.9462
179 ISN 0.9461
180 2D0 0.9461
181 B53 0.9461
182 AZ9 0.9460
183 3DM 0.9460
184 4HC 0.9458
185 QUZ 0.9457
186 JBH 0.9457
187 0HN 0.9457
188 4YS 0.9456
189 2ZM 0.9456
190 HQY 0.9455
191 36R 0.9454
192 M1Q 0.9454
193 3HA 0.9454
194 0HO 0.9452
195 5Q0 0.9450
196 FK1 0.9450
197 DBH 0.9449
198 ES2 0.9448
199 HQT 0.9448
200 5QY 0.9448
201 NPY 0.9447
202 CFP 0.9447
203 INO 0.9447
204 93K 0.9447
205 2CK 0.9446
206 54G 0.9446
207 4BZ 0.9446
208 NCA 0.9444
209 DX4 0.9442
210 5XC 0.9441
211 K2T 0.9441
212 2HQ 0.9440
213 H4N 0.9440
214 ES0 0.9439
215 AJ2 0.9439
216 CLW 0.9438
217 CTL 0.9438
218 8CM 0.9437
219 KUF 0.9437
220 7W4 0.9431
221 NBZ 0.9431
222 PE0 0.9430
223 NIO 0.9430
224 BOA 0.9430
225 F9Y 0.9430
226 HIO 0.9429
227 1P8 0.9428
228 XYP 0.9428
229 O72 0.9427
230 6GU 0.9424
231 290 0.9423
232 Q88 0.9423
233 9TW 0.9422
234 2A9 0.9421
235 M5K 0.9421
236 3NY 0.9421
237 PZA 0.9418
238 J9W 0.9417
239 BDP 0.9416
240 4CS 0.9416
241 CWM 0.9413
242 TDR 0.9412
243 P9P 0.9412
244 3M0 0.9409
245 MR1 0.9409
246 2HU 0.9407
247 JZ3 0.9406
248 0N7 0.9404
249 BEZ 0.9404
250 HQD 0.9403
251 ABI 0.9402
252 8GC 0.9402
253 BPN 0.9402
254 AQO 0.9400
255 G3E 0.9400
256 2ZV 0.9398
257 5VM 0.9398
258 24W 0.9397
259 8ZE 0.9397
260 NQ 0.9397
261 5NI 0.9397
262 SRT 0.9396
263 4P5 0.9396
264 CWS 0.9393
265 FHB 0.9393
266 1XN 0.9392
267 8S0 0.9392
268 FE DB1 0.9391
269 FBV 0.9390
270 D48 0.9390
271 PNZ 0.9390
272 MYJ 0.9387
273 IFM 0.9386
274 FB1 0.9386
275 INE 0.9385
276 37T 0.9384
277 RXA 0.9384
278 XX2 0.9383
279 TH0 0.9383
280 ANN 0.9382
281 6RQ 0.9380
282 KOJ 0.9379
283 GAB 0.9379
284 4XR 0.9379
285 PYQ 0.9378
286 1PT 0.9378
287 23A 0.9377
288 5JL 0.9377
289 HH5 0.9377
290 HPA 0.9376
291 HH8 0.9374
292 GYE 0.9374
293 4A3 0.9374
294 B62 0.9373
295 4VP 0.9372
296 L3Q 0.9370
297 2HO 0.9369
298 5M0 0.9369
299 3AB 0.9369
300 LXC 0.9368
301 1MC 0.9367
302 CTS 0.9367
303 6NI 0.9367
304 IV2 0.9366
305 NDH 0.9365
306 BEN 0.9363
307 5MH 0.9362
308 3HM 0.9361
309 NID 0.9361
310 6CS 0.9360
311 4XH 0.9359
312 MCT 0.9358
313 M6N 0.9357
314 1F1 0.9357
315 3A9 0.9357
316 SKA 0.9357
317 OAA 0.9357
318 NK 0.9356
319 0FO 0.9355
320 MUA 0.9354
321 M0W 0.9353
322 6PC 0.9353
323 3HB 0.9351
324 8NY 0.9351
325 FP1 0.9350
326 4ME 0.9350
327 SX1 0.9346
328 KJY 0.9346
329 XIY 0.9346
330 VK3 0.9345
331 LT2 0.9344
332 60P 0.9344
333 3NT 0.9343
334 XYD 0.9343
335 QWN 0.9343
336 7NI 0.9342
337 5MK 0.9341
338 BAM 0.9341
339 JAW 0.9340
340 10L 0.9339
341 J9Q 0.9338
342 R8A 0.9337
343 GAL 0.9337
344 LGC 0.9336
345 SE2 0.9335
346 8WO 0.9335
347 EQT 0.9334
348 UNU 0.9334
349 MQN 0.9334
350 8IG 0.9333
351 4ZE 0.9332
352 JBK 0.9332
353 RSF 0.9332
354 CHB 0.9332
355 G5V 0.9331
356 680 0.9331
357 1DW 0.9330
358 0R0 0.9330
359 3MG 0.9327
360 MWM 0.9326
361 KJU 0.9326
362 3WA 0.9326
363 XHP 0.9325
364 9TZ 0.9325
365 GAG 0.9323
366 286 0.9319
367 KBG 0.9319
368 4HM 0.9318
369 1M2 0.9316
370 Q6T 0.9316
371 ADE 0.9315
372 4JQ 0.9315
373 173 0.9315
374 LZM 0.9314
375 4JM 0.9314
376 3OC 0.9314
377 JLZ 0.9313
378 PBC 0.9311
379 WCE 0.9310
380 IDM 0.9308
381 2AC 0.9308
382 YCP 0.9307
383 DEN 0.9305
384 275 0.9304
385 OTR 0.9303
386 BSX 0.9303
387 QSB 0.9302
388 OVV 0.9301
389 4HO 0.9300
390 HDH 0.9300
391 4NM 0.9298
392 7VS 0.9298
393 3SK 0.9298
394 FBA 0.9297
395 J5I 0.9297
396 OTW 0.9297
397 42A 0.9296
398 BEA 0.9295
399 4JO 0.9293
400 APZ 0.9291
401 JZ9 0.9290
402 329 0.9289
403 6MP 0.9289
404 OXZ 0.9289
405 5HN 0.9289
406 2H5 0.9288
407 0W8 0.9287
408 9FL 0.9287
409 PXM 0.9287
410 BDF 0.9286
411 QX4 0.9286
412 4WL 0.9286
413 2AL 0.9286
414 SOE 0.9285
415 R9Y 0.9285
416 GCB 0.9282
417 QXW 0.9282
418 TTY 0.9282
419 15L 0.9281
420 948 0.9281
421 53C 0.9280
422 82I 0.9279
423 X05 0.9278
424 DBJ 0.9278
425 R8S 0.9278
426 A1U 0.9277
427 AMH 0.9277
428 XBZ 0.9276
429 717 0.9275
430 DQU 0.9274
431 RHU 0.9274
432 34A 0.9273
433 FCR 0.9273
434 9HX 0.9273
435 NTN 0.9273
436 BCP 0.9273
437 39A 0.9271
438 QSC 0.9271
439 43M 0.9270
440 3Z8 0.9270
441 SWD 0.9267
442 7HP 0.9267
443 261 0.9267
444 ISZ 0.9266
445 JZ2 0.9265
446 BTE 0.9265
447 TSU 0.9264
448 2MP 0.9263
449 2BG 0.9263
450 32X 0.9263
451 ASC 0.9262
452 92K 0.9261
453 WOO 0.9261
454 9DA 0.9259
455 MLT 0.9259
456 MNM 0.9258
457 AZF 0.9258
458 PYD 0.9256
459 ICP 0.9256
460 HLZ 0.9255
461 F1A 0.9255
462 TLA 0.9252
463 AFR 0.9252
464 SAN 0.9252
465 DHK 0.9251
466 FQI 0.9249
467 9MG 0.9249
468 42C 0.9248
469 FBT 0.9248
470 Z5P 0.9247
471 VNL 0.9247
472 LDP 0.9246
473 MZG 0.9244
474 ALL 0.9244
475 5RO 0.9244
476 4YO 0.9242
477 VGL 0.9242
478 0TU 0.9241
479 4TU 0.9240
480 EUG 0.9238
481 97T 0.9238
482 AC0 0.9237
483 KP6 0.9237
484 UEG 0.9236
485 IHB 0.9236
486 1P7 0.9236
487 OXQ 0.9234
488 GZL 0.9234
489 IND 0.9233
490 5GU 0.9233
491 M1E 0.9233
492 EKZ 0.9232
493 N2I 0.9232
494 KDV 0.9232
495 BHO 0.9230
496 LZ1 0.9229
497 X0V 0.9229
498 AAS 0.9228
499 3BZ 0.9228
500 DHR 0.9228
501 7WA 0.9227
502 6ME 0.9227
503 1LN 0.9225
504 44W 0.9225
505 259 0.9225
506 0R1 0.9224
507 4JP 0.9224
508 4JJ 0.9223
509 BZI 0.9222
510 OVM 0.9222
511 HT4 0.9221
512 BZF 0.9221
513 BE7 0.9221
514 X09 0.9221
515 GVH 0.9218
516 MO8 0.9218
517 2YU 0.9217
518 MPI 0.9217
519 DRL 0.9217
520 PM6 0.9216
521 2LP 0.9215
522 GLF 0.9215
523 GDE 0.9215
524 FUL 0.9213
525 IP0 0.9212
526 AEF 0.9212
527 TEP 0.9211
528 GXL 0.9211
529 3IT 0.9211
530 CWJ 0.9210
531 CFI 0.9210
532 ADA 0.9209
533 SKM 0.9209
534 JBQ 0.9208
535 GBD 0.9206
536 LNR 0.9206
537 L99 0.9206
538 BP1 0.9205
539 4CL 0.9203
540 TM7 0.9202
541 6VD 0.9202
542 ARB 0.9201
543 PRF 0.9200
544 DS0 0.9200
545 SS1 0.9200
546 C2Y 0.9199
547 QAS 0.9198
548 S76 0.9198
549 DIE 0.9197
550 JZ1 0.9194
551 5WY 0.9194
552 4J8 0.9193
553 PDC 0.9193
554 MWJ 0.9192
555 SHG 0.9191
556 HY1 0.9191
557 3MB 0.9191
558 QAT 0.9190
559 AJV 0.9189
560 BNS 0.9188
561 BRT 0.9188
562 4MU 0.9187
563 DFB 0.9187
564 92P 0.9186
565 27Y 0.9185
566 H62 0.9185
567 MVN 0.9185
568 XYL 0.9184
569 RB5 0.9184
570 PA1 0.9184
571 PRZ 0.9183
572 2FG 0.9183
573 495 0.9180
574 KYD 0.9180
575 4FH 0.9180
576 MT0 0.9179
577 FPY 0.9179
578 M58 0.9179
579 DMJ 0.9179
580 OW4 0.9179
581 GXY 0.9178
582 25W 0.9178
583 HJP 0.9177
584 44V 0.9177
585 FBS 0.9177
586 52C 0.9177
587 EHM 0.9176
588 DHQ 0.9176
589 H8N 0.9176
590 EYK 0.9175
591 5JC 0.9173
592 0JD 0.9173
593 GLA 0.9173
594 DYA 0.9173
595 3XX 0.9173
596 7ZE 0.9171
597 4JL 0.9171
598 5AC 0.9170
599 JDN 0.9170
600 4FA 0.9170
601 AKH 0.9169
602 PQ0 0.9169
603 GJS 0.9168
604 QPR 0.9168
605 5B1 0.9167
606 ES4 0.9167
607 94B 0.9166
608 9CA 0.9166
609 IT2 0.9165
610 NTM 0.9165
611 SJ5 0.9164
612 GAF 0.9164
613 2AK 0.9163
614 7MU 0.9163
615 F81 0.9162
616 HX3 0.9162
617 0CT 0.9161
618 DFU 0.9161
619 FH2 0.9160
620 RIP 0.9159
621 YQA 0.9159
622 9R5 0.9159
623 RIB 0.9158
624 NIZ 0.9158
625 3RK 0.9156
626 G6D 0.9156
627 15N 0.9156
628 FDK 0.9155
629 HIS 0.9155
630 EVA 0.9154
631 FBM 0.9154
632 JZ4 0.9154
633 GIV 0.9154
634 XYS 0.9154
635 ZWZ 0.9153
636 F31 0.9152
637 7N0 0.9152
638 GTR 0.9152
639 BCU 0.9148
640 TGX 0.9147
641 XQG 0.9145
642 PRY 0.9144
643 2A7 0.9143
644 RPQ 0.9143
645 2MN 0.9142
646 N8Y 0.9142
647 3FH 0.9142
648 8WT 0.9141
649 TAR 0.9140
650 069 0.9139
651 15E 0.9138
652 LSA 0.9136
653 GM7 0.9135
654 UNC 0.9135
655 4XV 0.9134
656 2LY 0.9133
657 94W 0.9131
658 DGJ 0.9130
659 P3K 0.9130
660 UAN 0.9129
661 PHT 0.9129
662 RBL 0.9128
663 N2Z 0.9128
664 12T 0.9127
665 JB8 0.9127
666 BR9 0.9125
667 NDM 0.9124
668 4ZA 0.9123
669 DBX 0.9123
670 VOH 0.9122
671 RNS 0.9122
672 BMA 0.9121
673 149 0.9121
674 2FQ 0.9120
675 14J 0.9120
676 JTH 0.9120
677 R9S 0.9120
678 G4D 0.9119
679 HZQ 0.9118
680 SVD 0.9118
681 IFP 0.9117
682 GZ8 0.9117
683 1P3 0.9116
684 JA8 0.9115
685 SXS 0.9115
686 AMS 0.9114
687 QSH 0.9114
688 KIB 0.9113
689 KIA 0.9113
690 LDU 0.9112
691 HY3 0.9112
692 LMR 0.9111
693 0F9 0.9111
694 PZM 0.9110
695 12M 0.9110
696 M4E 0.9108
697 FAN 0.9108
698 KBB 0.9108
699 0FN 0.9108
700 ZXD 0.9107
701 II6 0.9106
702 TOF 0.9104
703 5WX 0.9104
704 4JU 0.9104
705 HA5 0.9104
706 AKG 0.9103
707 QX2 0.9102
708 F12 0.9102
709 2TQ 0.9101
710 J6W 0.9101
711 6LW 0.9100
712 0MK 0.9100
713 PD2 0.9100
714 FOT 0.9098
715 ZB1 0.9097
716 AGK 0.9096
717 1AB 0.9095
718 JIF 0.9095
719 7VJ 0.9095
720 K5W 0.9094
721 I1E 0.9093
722 B60 0.9093
723 PZI 0.9093
724 PEY 0.9093
725 TLD 0.9090
726 DIU 0.9090
727 1IT 0.9087
728 C2B 0.9086
729 PH2 0.9086
730 9RW 0.9085
731 CFF 0.9085
732 2KA 0.9084
733 V55 0.9084
734 MRZ 0.9083
735 XUL 0.9083
736 3AL 0.9082
737 GIF 0.9081
738 209 0.9081
739 YIO 0.9081
740 3Z7 0.9080
741 2ZQ 0.9079
742 F5B 0.9078
743 1WG 0.9078
744 YRL 0.9078
745 OXC 0.9077
746 X6X 0.9076
747 ABE 0.9075
748 PCA 0.9075
749 MBG 0.9075
750 FGZ 0.9075
751 TYL 0.9075
752 CLZ 0.9074
753 SN4 0.9074
754 1GN 0.9074
755 GIO 0.9073
756 FUC 0.9072
757 E7S 0.9072
758 PLQ 0.9071
759 PFB 0.9070
760 F0J 0.9069
761 ORO 0.9069
762 R2B 0.9068
763 RAT 0.9067
764 IF7 0.9067
765 HQE 0.9066
766 THE 0.9065
767 IJZ 0.9064
768 MAQ 0.9063
769 PBA 0.9063
770 RSO 0.9062
771 EDG 0.9059
772 IDH 0.9056
773 4SX 0.9056
774 LKA 0.9055
775 HQJ 0.9055
776 MAN 0.9052
777 GJP 0.9052
778 AW5 0.9051
779 6KT 0.9051
780 2MH 0.9050
781 INS 0.9050
782 NGO 0.9049
783 GOX 0.9049
784 8W9 0.9048
785 4XS 0.9047
786 E1T 0.9047
787 HA7 0.9047
788 SEP 0.9045
789 PHU 0.9045
790 7WG 0.9045
791 RMN 0.9045
792 F9P 0.9043
793 H33 0.9042
794 T6C 0.9042
795 4M4 0.9041
796 34D 0.9041
797 UFO 0.9041
798 PAF 0.9039
799 D07 0.9038
800 C2U 0.9038
801 ISE 0.9038
802 0LH 0.9035
803 SMN 0.9035
804 9KT 0.9034
805 A29 0.9033
806 BZ2 0.9033
807 MSR 0.9032
808 PCR 0.9031
809 MZB 0.9030
810 0TR 0.9028
811 JND 0.9027
812 GUA 0.9027
813 HHH 0.9025
814 RAM 0.9025
815 12B 0.9025
816 MRY 0.9024
817 PYG 0.9024
818 MXN 0.9023
819 AMC 0.9022
820 7MH 0.9022
821 DHS 0.9020
822 J9T 0.9020
823 LG4 0.9020
824 449 0.9018
825 FCB 0.9017
826 23J 0.9015
827 Y8I 0.9014
828 3HG 0.9012
829 SYN 0.9012
830 2XX 0.9011
831 K17 0.9010
832 TSS 0.9009
833 2F6 0.9009
834 GOJ 0.9009
835 7D2 0.9008
836 PKU 0.9008
837 I3E 0.9006
838 25R 0.9005
839 6FZ 0.9005
840 MFB 0.9004
841 URP 0.9004
842 GLU 0.9003
843 MT5 0.9002
844 M1H 0.9002
845 YSO 0.9002
846 GOO 0.9000
847 XXR 0.9000
848 2DR 0.8999
849 4ZC 0.8999
850 OA3 0.8998
851 MAE 0.8998
852 MZW 0.8997
853 PXY 0.8996
854 SOR 0.8995
855 KLW 0.8994
856 4RU 0.8993
857 45L 0.8991
858 ZZ8 0.8990
859 FUD 0.8990
860 DOR 0.8989
861 TSR 0.8989
862 EJZ 0.8989
863 8OZ 0.8989
864 ABN 0.8988
865 CIT 0.8988
866 GCW 0.8987
867 QOS 0.8987
868 DEE 0.8986
869 TPA 0.8986
870 TAG 0.8985
871 HC4 0.8985
872 2FT 0.8984
873 GMN 0.8984
874 PEZ 0.8984
875 JFD 0.8982
876 M0Q 0.8980
877 3FA 0.8979
878 FFP 0.8979
879 SKG 0.8979
880 NMJ 0.8979
881 4CH 0.8978
882 ARA 0.8978
883 2MY 0.8977
884 UY7 0.8977
885 ZZ3 0.8977
886 ICB 0.8977
887 BK9 0.8975
888 QWW 0.8974
889 MBD 0.8974
890 T9G 0.8974
891 ADK 0.8973
892 293 0.8973
893 4NB 0.8973
894 LYL 0.8972
895 9ZE 0.8972
896 ILE 0.8971
897 LQ2 0.8971
898 FPN 0.8970
899 35C 0.8970
900 51R 0.8970
901 4VY 0.8968
902 1DV 0.8968
903 1AL 0.8967
904 GLT 0.8967
905 3MA 0.8967
906 GCV 0.8966
907 9FE 0.8966
908 DA1 0.8965
909 JUG 0.8965
910 AHB 0.8965
911 M2H 0.8965
912 FA1 0.8965
913 3MC 0.8964
914 2C9 0.8963
915 S2G 0.8963
916 AL0 0.8962
917 TBS 0.8961
918 SF9 0.8961
919 2CQ 0.8960
920 7CZ 0.8960
921 FCA 0.8960
922 ASP 0.8960
923 APG 0.8960
924 FRU 0.8959
925 3CE 0.8957
926 OHP 0.8956
927 6TZ 0.8955
928 OVP 0.8952
929 OHG 0.8952
930 MWP 0.8951
931 XXP 0.8951
932 FUB 0.8950
933 FLM 0.8950
934 SRO 0.8950
935 ESP 0.8950
936 GLY PRO 0.8949
937 EV0 0.8949
938 64K 0.8948
939 RM4 0.8947
940 DE5 0.8945
941 HBX 0.8945
942 1HN 0.8944
943 7ME 0.8943
944 JG8 0.8943
945 45C 0.8942
946 27B 0.8942
947 HHR 0.8940
948 FB2 0.8940
949 DNF 0.8940
950 39O 0.8938
951 RD4 0.8937
952 PEA 0.8936
953 SYA 0.8935
954 2CM 0.8935
955 4P0 0.8935
956 SD4 0.8934
957 JXN 0.8933
958 HSO 0.8931
959 OW7 0.8931
960 GVG 0.8931
961 ZYR 0.8930
962 DPZ 0.8929
963 SNO 0.8929
964 23W 0.8928
965 95Z 0.8927
966 K34 0.8927
967 3R6 0.8927
968 ONR 0.8926
969 D1X 0.8925
970 PEP 0.8925
971 FUF 0.8925
972 LI6 0.8925
973 282 0.8925
974 KYA 0.8925
975 150 0.8924
976 3BU 0.8923
977 6JN 0.8922
978 6MH 0.8922
979 1SA 0.8922
980 8G0 0.8921
981 J1Z 0.8920
982 PMB 0.8920
983 SLS 0.8919
984 4HS 0.8919
985 M4S 0.8919
986 TZF 0.8918
987 NGT 0.8917
988 BML 0.8917
989 K3Q 0.8916
990 PIM 0.8915
991 PFL 0.8915
992 Q02 0.8914
993 DUB 0.8914
994 M4T 0.8914
995 4JC 0.8914
996 TZE 0.8913
997 DQN 0.8913
998 FPI 0.8913
999 51F 0.8912
1000 CH9 0.8911
1001 9PY 0.8910
1002 R1X 0.8910
1003 PHH 0.8910
1004 ASN 0.8909
1005 A65 0.8909
1006 ARW 0.8909
1007 PRO 0.8908
1008 JZ5 0.8908
1009 CXF 0.8907
1010 COI 0.8907
1011 LPK 0.8906
1012 8EW 0.8905
1013 H76 0.8905
1014 2GS 0.8904
1015 HDL 0.8904
1016 NVU 0.8904
1017 284 0.8904
1018 1KP 0.8903
1019 HSE 0.8902
1020 PBE 0.8898
1021 GOG 0.8897
1022 TWO 0.8897
1023 EXO 0.8896
1024 HYP 0.8895
1025 AJY 0.8895
1026 7WR 0.8895
1027 FA3 0.8894
1028 SNU 0.8894
1029 MSN 0.8893
1030 MFU 0.8893
1031 XCZ 0.8893
1032 3ZQ 0.8893
1033 DNA 0.8893
1034 K32 0.8891
1035 G1O 0.8891
1036 F4Z 0.8890
1037 QY9 0.8890
1038 WOT 0.8890
1039 OMD 0.8889
1040 F4E 0.8887
1041 8XL 0.8886
1042 GLL 0.8885
1043 20J 0.8884
1044 7B3 0.8883
1045 0OC 0.8882
1046 HKD 0.8881
1047 ICF 0.8879
1048 PAC 0.8879
1049 PJW 0.8879
1050 FBW 0.8879
1051 TM4 0.8878
1052 CRS 0.8877
1053 OK7 0.8876
1054 S24 0.8876
1055 L5V 0.8876
1056 A13 0.8876
1057 GCO 0.8876
1058 AH8 0.8875
1059 PY7 0.8875
1060 HFB 0.8875
1061 Q71 0.8875
1062 XBT 0.8875
1063 ZVO 0.8874
1064 JU2 0.8873
1065 PYC 0.8872
1066 CPZ 0.8872
1067 2PG 0.8871
1068 QIC 0.8871
1069 IAC 0.8871
1070 PQK 0.8870
1071 NK2 0.8869
1072 FDR 0.8867
1073 BP9 0.8866
1074 PYF 0.8866
1075 PIY 0.8865
1076 URA 0.8864
1077 2PC 0.8863
1078 TBP 0.8862
1079 4JN 0.8862
1080 C21 0.8862
1081 5XB 0.8861
1082 NCT 0.8861
1083 HXX 0.8861
1084 7MX 0.8860
1085 RNO 0.8860
1086 AIN 0.8859
1087 N7P 0.8857
1088 AA 0.8857
1089 XX3 0.8856
1090 EMZ 0.8855
1091 GLO 0.8853
1092 GZQ 0.8852
1093 PX7 0.8852
1094 C2A 0.8850
1095 SYG 0.8850
1096 40O 0.8849
1097 HGQ 0.8849
1098 H5B 0.8849
1099 S7J 0.8848
1100 NTZ 0.8847
1101 GJZ 0.8847
1102 2HG 0.8846
1103 TT4 0.8846
1104 ESX 0.8846
1105 KBZ 0.8846
1106 L14 0.8844
1107 XRG 0.8842
1108 TC7 0.8840
1109 K97 0.8840
1110 RCO 0.8839
1111 265 0.8836
1112 5VL 0.8836
1113 938 0.8835
1114 6UA 0.8835
1115 M3H 0.8834
1116 FPK 0.8832
1117 ESI 0.8831
1118 RBJ 0.8830
1119 5WU 0.8830
1120 9TY 0.8830
1121 I6G 0.8829
1122 J9N 0.8829
1123 3MH 0.8828
1124 GV9 0.8828
1125 1U6 0.8827
1126 EOL 0.8826
1127 MAK 0.8826
1128 FLV 0.8826
1129 GIM 0.8825
1130 PEQ 0.8823
1131 GTZ 0.8823
1132 TEO 0.8823
1133 2CH 0.8822
1134 3SL 0.8822
1135 NCD 0.8822
1136 47J 0.8820
1137 MAJ 0.8819
1138 260 0.8818
1139 TVP 0.8818
1140 A7N 0.8818
1141 IOL 0.8818
1142 94N 0.8816
1143 DGN 0.8815
1144 K22 0.8815
1145 ZBT 0.8815
1146 1MR 0.8814
1147 69O 0.8811
1148 O2A 0.8810
1149 JBN 0.8810
1150 UFV 0.8807
1151 K2P 0.8806
1152 BEW 0.8805
1153 BCF 0.8804
1154 NBE 0.8803
1155 8HC 0.8802
1156 GF4 0.8802
1157 DII 0.8801
1158 VXX 0.8801
1159 FOA 0.8801
1160 KIV 0.8801
1161 SMV 0.8800
1162 SPV 0.8799
1163 HTP 0.8798
1164 1WC 0.8798
1165 CAQ 0.8797
1166 AN3 0.8797
1167 428 0.8797
1168 3V4 0.8796
1169 IPZ 0.8796
1170 BZJ 0.8795
1171 0W1 0.8795
1172 H3M 0.8794
1173 JZ0 0.8793
1174 1DU 0.8792
1175 GNM 0.8791
1176 HCS 0.8791
1177 BPU 0.8791
1178 OXE 0.8790
1179 SR1 0.8789
1180 26D 0.8786
1181 KTJ 0.8786
1182 3CH 0.8785
1183 IBF 0.8781
1184 HX2 0.8781
1185 EN1 0.8781
1186 92Z 0.8780
1187 FHN 0.8779
1188 1AN 0.8778
1189 86L 0.8777
1190 LRH 0.8776
1191 28N 0.8775
1192 1XX 0.8775
1193 FLC 0.8775
1194 B5D 0.8774
1195 8K2 0.8773
1196 8LG 0.8772
1197 7MK 0.8772
1198 226 0.8772
1199 BSP 0.8771
1200 5LA 0.8771
1201 AX3 0.8771
1202 ALO 0.8770
1203 5DI 0.8769
1204 2HC 0.8769
1205 HNQ 0.8768
1206 280 0.8768
1207 ANF 0.8768
1208 BBF 0.8767
1209 TP5 0.8767
1210 QMP 0.8766
1211 LDR 0.8766
1212 JFJ 0.8763
1213 HHI 0.8763
1214 GGL 0.8763
1215 OGA 0.8763
1216 93Q 0.8761
1217 AMG 0.8760
1218 R67 0.8759
1219 DQA 0.8757
1220 4PW 0.8756
1221 NAG 0.8756
1222 NEQ 0.8754
1223 F3B 0.8751
1224 13X 0.8750
1225 H6B 0.8750
1226 PCI 0.8749
1227 SS2 0.8749
1228 0FK 0.8748
1229 ENL 0.8748
1230 KGK 0.8747
1231 FP2 0.8746
1232 ZZZ 0.8745
1233 B24 0.8745
1234 LG3 0.8744
1235 UNJ 0.8744
1236 CYT 0.8743
1237 2AS 0.8742
1238 BR8 0.8742
1239 30G 0.8742
1240 2AF 0.8741
1241 GLN 0.8741
1242 J01 0.8741
1243 L89 0.8740
1244 1QP 0.8740
1245 HTS 0.8739
1246 GZ3 0.8736
1247 K8X 0.8736
1248 A7H 0.8735
1249 40E 0.8734
1250 MVL 0.8734
1251 W81 0.8733
1252 G12 0.8732
1253 G3P 0.8731
1254 KTA 0.8731
1255 1A7 0.8729
1256 BVF 0.8729
1257 HQ9 0.8727
1258 HLD 0.8727
1259 4XX 0.8725
1260 6KX 0.8724
1261 8NX 0.8724
1262 HHT 0.8723
1263 L7T 0.8722
1264 WDL 0.8721
1265 TZC 0.8718
1266 6BL 0.8718
1267 APY 0.8716
1268 LG5 0.8715
1269 X8D 0.8713
1270 5NE 0.8713
1271 TMZ 0.8713
1272 SIF 0.8712
1273 CGB 0.8710
1274 SME 0.8710
1275 KTW 0.8710
1276 2CL 0.8709
1277 RUU 0.8709
1278 R20 0.8708
1279 OTD 0.8708
1280 XXG 0.8707
1281 0BP 0.8707
1282 6X8 0.8707
1283 5ZE 0.8706
1284 ECE 0.8706
1285 76X 0.8705
1286 4H2 0.8705
1287 AEZ 0.8705
1288 Q7A 0.8704
1289 GSY 0.8703
1290 PHE 0.8703
1291 I1N 0.8703
1292 4BY 0.8703
1293 N8P 0.8702
1294 PYJ 0.8702
1295 B3R 0.8699
1296 KW8 0.8698
1297 XDE 0.8697
1298 PEL 0.8697
1299 285 0.8697
1300 4BL 0.8695
1301 39U 0.8694
1302 8XQ 0.8694
1303 DNC 0.8694
1304 8GF 0.8693
1305 B2J 0.8692
1306 3AY 0.8692
1307 5NS 0.8690
1308 URQ 0.8688
1309 091 0.8687
1310 AEH 0.8687
1311 N3W 0.8687
1312 4HP 0.8687
1313 9AP 0.8687
1314 AX2 0.8686
1315 9X7 0.8682
1316 OEM 0.8682
1317 2ZX 0.8682
1318 36E 0.8682
1319 FBF 0.8681
1320 278 0.8680
1321 DTU 0.8680
1322 HEW 0.8680
1323 2O6 0.8679
1324 DHY 0.8679
1325 K6X 0.8679
1326 VAL 0.8678
1327 5CL 0.8677
1328 42J 0.8676
1329 MMA 0.8675
1330 THA 0.8675
1331 DUC 0.8673
1332 P4B 0.8672
1333 271 0.8671
1334 ARP 0.8670
1335 M45 0.8669
1336 4KL 0.8669
1337 E3D 0.8667
1338 FLA 0.8662
1339 JAB 0.8661
1340 6HQ 0.8660
1341 TFU 0.8659
1342 TMT 0.8658
1343 36Y 0.8656
1344 BNT 0.8655
1345 3ZB 0.8655
1346 4TE 0.8654
1347 YTB 0.8654
1348 463 0.8652
1349 KMH 0.8649
1350 152 0.8648
1351 CIG 0.8647
1352 M44 0.8647
1353 M3T 0.8645
1354 NXA 0.8644
1355 DRG 0.8644
1356 REL 0.8642
1357 KFH 0.8641
1358 5AN 0.8640
1359 YAN 0.8639
1360 NDG 0.8639
1361 5TY 0.8638
1362 MPV 0.8637
1363 NF3 0.8635
1364 BNL 0.8635
1365 IWT 0.8634
1366 SNE 0.8633
1367 0GZ 0.8633
1368 TFB 0.8632
1369 4I8 0.8631
1370 FK8 0.8622
1371 BNF 0.8622
1372 URS 0.8620
1373 ERH 0.8619
1374 3QV 0.8619
1375 LEU 0.8618
1376 A5E 0.8614
1377 1XA 0.8606
1378 FBU 0.8605
1379 APS 0.8599
1380 MHK 0.8594
1381 A09 0.8594
1382 4SD 0.8594
1383 OQC 0.8593
1384 3GQ 0.8589
1385 X0U 0.8589
1386 Q07 0.8588
1387 GBN 0.8588
1388 FSW 0.8582
1389 SF6 0.8581
1390 MET 0.8579
1391 GWM 0.8579
1392 HPY 0.8577
1393 1DQ 0.8577
1394 ROI 0.8574
1395 SLC 0.8569
1396 ICC 0.8566
1397 DX3 0.8565
1398 EXD 0.8563
1399 1L5 0.8562
1400 LZ2 0.8561
1401 DTL 0.8555
1402 535 0.8551
1403 K37 0.8549
1404 LT8 0.8548
1405 13P 0.8546
1406 THR 0.8542
1407 0XT 0.8542
1408 HHQ 0.8540
1409 6QF 0.8534
1410 NLE 0.8530
1411 Z13 0.8520
1412 BBK 0.8518
1413 R1P 0.8514
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 4WS6; Ligand: WBU; Similar sites found with APoc: 2
This union binding pocket(no: 1) in the query (biounit: 4ws6.bio1) has 12 residues
No: Leader PDB Ligand Sequence Similarity
1 1UDH URA 36.9748
2 3FCI 3FI 45.7399
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