Receptor
PDB id Resolution Class Description Source Keywords
3NC2 2.5 Å EC: 2.7.1.3 X-RAY STRUCTURE OF KETOHEXOKINASE WITH A QUINAZOLINE HOMO SAPIENS KETOHEXOKINASE TRANSFERASE TRANSFERASE-TRANSFERASE INHIBITCOMPLEX
Ref.: ELECTRON DENSITY GUIDED FRAGMENT-BASED LEAD DISCOVE KETOHEXOKINASE INHIBITORS. J.MED.CHEM. V. 53 7979 2010
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
QUZ A:299;
B:299;
 Valid;
Valid;
 none;
none;
 submit data
130.147 C8 H6 N2 c1ccc...
SO4 A:300;
B:300;
B:301;
 Invalid;
Invalid;
Invalid;
 none;
none;
none;
 submit data
96.063 O4 S [O-]S...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
6W0Z 2.3 Å EC: 2.7.1.3 STRUCTURE OF KHK IN COMPLEX WITH COMPOUND 8 (2-[(1~{S},5~{R} [(2~{S})-2-METHYLAZETIDIN-1-YL]-6-(TRIFLUOROMETHYL)PYRIMIDIA ZABICYCLO[3.1.0]HEXAN-6-YL]ETHANOIC ACID) HOMO SAPIENS KETOHEXOKINASE TRANSFERASE
Ref.: DISCOVERY OF PF-06835919: A POTENT INHIBITOR OF KETOHEXOKINASE (KHK) FOR THE TREATMENT OF METABOLIC DISORDERS DRIVEN BY THE OVERCONSUMPTION OF FRUCTOSE J.MED.CHEM. V. 63 13546 2020
Members (11)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 6W0Z ic50 = 0.01 uM S6D C16 H19 F3 N4 O2 C[C@H]1CCN....
2 3NBW - TR4 C11 H10 N4 S CSc1c(c(n(....
3 5WBM Kd = 20 uM A4G C13 H18 N4 O Cc1c[nH]c2....
4 5WBO Kd = 62 uM A1Y C12 H15 N3 O Cc1cc(nc(c....
5 6W0X ic50 = 0.14 uM S6J C17 H19 F3 N4 O2 C[C@H]1[C@....
6 5WBQ ic50 = 1.48 uM A3J C16 H17 F3 N4 O CCc1cc2c([....
7 6W0N ic50 = 0.41 uM RYS C16 H19 F3 N4 O3 C[C@@]1(CC....
8 3NBV - FRU C6 H12 O6 C([C@@H]1[....
9 5WBZ ic50 = 0.39 uM A4J C16 H19 F3 N4 O3 C[C@@]1(CC....
10 3NC2 - QUZ C8 H6 N2 c1ccc2c(c1....
11 3NC9 ic50 = 330 nM TR3 C20 H22 N4 O S CSc1c2ccc(....
70% Homology Family (12)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 6W0Z ic50 = 0.01 uM S6D C16 H19 F3 N4 O2 C[C@H]1CCN....
2 3NBW - TR4 C11 H10 N4 S CSc1c(c(n(....
3 5WBM Kd = 20 uM A4G C13 H18 N4 O Cc1c[nH]c2....
4 5WBO Kd = 62 uM A1Y C12 H15 N3 O Cc1cc(nc(c....
5 6W0X ic50 = 0.14 uM S6J C17 H19 F3 N4 O2 C[C@H]1[C@....
6 5WBQ ic50 = 1.48 uM A3J C16 H17 F3 N4 O CCc1cc2c([....
7 6W0N ic50 = 0.41 uM RYS C16 H19 F3 N4 O3 C[C@@]1(CC....
8 3NBV - FRU C6 H12 O6 C([C@@H]1[....
9 5WBZ ic50 = 0.39 uM A4J C16 H19 F3 N4 O3 C[C@@]1(CC....
10 3NC2 - QUZ C8 H6 N2 c1ccc2c(c1....
11 3NC9 ic50 = 330 nM TR3 C20 H22 N4 O S CSc1c2ccc(....
12 2HW1 - FRU C6 H12 O6 C([C@@H]1[....
50% Homology Family (12)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 6W0Z ic50 = 0.01 uM S6D C16 H19 F3 N4 O2 C[C@H]1CCN....
2 3NBW - TR4 C11 H10 N4 S CSc1c(c(n(....
3 5WBM Kd = 20 uM A4G C13 H18 N4 O Cc1c[nH]c2....
4 5WBO Kd = 62 uM A1Y C12 H15 N3 O Cc1cc(nc(c....
5 6W0X ic50 = 0.14 uM S6J C17 H19 F3 N4 O2 C[C@H]1[C@....
6 5WBQ ic50 = 1.48 uM A3J C16 H17 F3 N4 O CCc1cc2c([....
7 6W0N ic50 = 0.41 uM RYS C16 H19 F3 N4 O3 C[C@@]1(CC....
8 3NBV - FRU C6 H12 O6 C([C@@H]1[....
9 5WBZ ic50 = 0.39 uM A4J C16 H19 F3 N4 O3 C[C@@]1(CC....
10 3NC2 - QUZ C8 H6 N2 c1ccc2c(c1....
11 3NC9 ic50 = 330 nM TR3 C20 H22 N4 O S CSc1c2ccc(....
12 2HW1 - FRU C6 H12 O6 C([C@@H]1[....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: QUZ; Similar ligands found: 1
No: Ligand ECFP6 Tc MDL keys Tc
1 QUZ 1 1
Similar Ligands (3D)
Ligand no: 1; Ligand: QUZ; Similar ligands found: 1120
No: Ligand Similarity coefficient
1 NPY 1.0000
2 1PT 0.9985
3 2CK 0.9910
4 DEN 0.9882
5 9EW 0.9865
6 0RW 0.9860
7 F05 0.9855
8 IND 0.9846
9 BEN 0.9842
10 BEZ 0.9840
11 BAM 0.9836
12 BZI 0.9829
13 HLR 0.9824
14 1NP 0.9822
15 BZF 0.9819
16 0R1 0.9816
17 MPI 0.9813
18 LZ1 0.9812
19 O72 0.9809
20 1SQ 0.9808
21 6M9 0.9808
22 5Q0 0.9807
23 4YS 0.9806
24 0CT 0.9805
25 NCA 0.9802
26 GVH 0.9801
27 1LQ 0.9800
28 ES1 0.9798
29 6PC 0.9798
30 SVN 0.9797
31 4JP 0.9797
32 HQY 0.9794
33 JPZ 0.9793
34 YCP 0.9792
35 ISN 0.9784
36 5IQ 0.9781
37 5SG 0.9781
38 COU 0.9781
39 JBH 0.9779
40 BZX 0.9776
41 XM0 0.9774
42 N5J 0.9770
43 1LM 0.9770
44 03V 0.9767
45 5WV 0.9767
46 XYP 0.9764
47 ES7 0.9762
48 2AQ 0.9762
49 14O 0.9761
50 6M4 0.9761
51 KKN 0.9756
52 5H1 0.9752
53 IDM 0.9750
54 F60 0.9750
55 ABV 0.9749
56 OCH 0.9749
57 24W 0.9744
58 AX7 0.9743
59 270 0.9743
60 SAL 0.9742
61 JAE 0.9737
62 ES5 0.9735
63 4FS 0.9733
64 JB5 0.9732
65 NIO 0.9732
66 6AI 0.9729
67 BHO 0.9729
68 NBZ 0.9727
69 NTN 0.9727
70 7W4 0.9723
71 LXC 0.9716
72 5MI 0.9713
73 H42 0.9713
74 2K4 0.9709
75 5MB 0.9704
76 3U4 0.9700
77 JBE 0.9695
78 UNU 0.9691
79 4SV 0.9688
80 2MI 0.9685
81 BE2 0.9677
82 4XH 0.9674
83 PZA 0.9670
84 3ID 0.9667
85 NPO 0.9665
86 HH8 0.9660
87 VGL 0.9657
88 P92 0.9656
89 PBC 0.9641
90 SS1 0.9641
91 DMD 0.9636
92 11S 0.9635
93 NK 0.9634
94 M1A 0.9631
95 ADE 0.9630
96 ES6 0.9629
97 BE7 0.9629
98 ES9 0.9628
99 PHB 0.9625
100 RSF 0.9625
101 JZ9 0.9620
102 KJH 0.9618
103 1WG 0.9613
104 67N 0.9609
105 0TR 0.9609
106 3PF 0.9609
107 H4N 0.9608
108 HPA 0.9603
109 1P7 0.9599
110 AHR 0.9599
111 1WD 0.9598
112 XQ0 0.9598
113 R8V 0.9597
114 FK1 0.9594
115 JKE 0.9593
116 SWD 0.9593
117 10L 0.9588
118 12Q 0.9581
119 TH7 0.9580
120 AC0 0.9575
121 9DA 0.9572
122 BTE 0.9569
123 ADZ 0.9564
124 BP1 0.9562
125 7WA 0.9561
126 5RG 0.9561
127 9HX 0.9560
128 6MP 0.9558
129 7WV 0.9556
130 HBD 0.9556
131 7W1 0.9552
132 1Y6 0.9548
133 8GC 0.9546
134 32X 0.9542
135 5B1 0.9541
136 3WA 0.9541
137 Q88 0.9538
138 0P6 0.9537
139 7HP 0.9536
140 173 0.9534
141 JBQ 0.9533
142 8NY 0.9533
143 150 0.9532
144 5QX 0.9532
145 PAB 0.9532
146 5QY 0.9532
147 EQT 0.9530
148 1DW 0.9528
149 FOA 0.9527
150 XYS 0.9521
151 G3E 0.9520
152 HMH 0.9520
153 TTL 0.9520
154 DBH 0.9519
155 J1Z 0.9515
156 1XN 0.9511
157 3F0 0.9510
158 PXL 0.9510
159 2CQ 0.9509
160 25W 0.9509
161 URF 0.9508
162 3HA 0.9507
163 BGC 0.9507
164 EA1 0.9500
165 CWS 0.9500
166 ES0 0.9499
167 FE DB1 0.9498
168 JBK 0.9498
169 HQT 0.9497
170 7CZ 0.9495
171 PRO 0.9495
172 L3Q 0.9494
173 FYU 0.9494
174 ET2 0.9493
175 QSC 0.9488
176 MCT 0.9488
177 8CM 0.9487
178 CWM 0.9487
179 QWN 0.9486
180 A7W 0.9483
181 M58 0.9482
182 KUF 0.9481
183 PM6 0.9474
184 TH0 0.9472
185 2D0 0.9471
186 5CU 0.9471
187 3M0 0.9470
188 Q24 0.9470
189 SE2 0.9470
190 DIN 0.9469
191 PYC 0.9469
192 ES4 0.9466
193 DOB 0.9464
194 D48 0.9464
195 GBD 0.9461
196 OAA 0.9461
197 5NU 0.9457
198 7B4 0.9456
199 PE0 0.9455
200 7HQ 0.9455
201 FA0 0.9455
202 JZ3 0.9455
203 3AB 0.9455
204 BHA 0.9453
205 LT2 0.9447
206 M1Q 0.9446
207 MWM 0.9444
208 AZA 0.9444
209 GTQ 0.9442
210 1MC 0.9442
211 4CS 0.9440
212 TP5 0.9438
213 MRW 0.9437
214 SYV 0.9436
215 AZ8 0.9436
216 GLC 0.9436
217 G6D 0.9436
218 4M0 0.9434
219 TDR 0.9434
220 PBZ 0.9434
221 6F0 0.9432
222 FBB 0.9432
223 FAN 0.9432
224 CLW 0.9432
225 DHQ 0.9432
226 36R 0.9431
227 Z82 0.9431
228 GRE 0.9429
229 J5I 0.9429
230 9DG 0.9425
231 23A 0.9424
232 2ZV 0.9424
233 5HN 0.9424
234 WBU 0.9423
235 OXQ 0.9420
236 GAB 0.9415
237 3HB 0.9415
238 53C 0.9415
239 M5K 0.9413
240 MEW 0.9413
241 ISZ 0.9412
242 4JT 0.9412
243 VGD 0.9410
244 826 0.9410
245 3NT 0.9409
246 ES2 0.9409
247 QXW 0.9409
248 1P8 0.9408
249 DHB 0.9407
250 54G 0.9406
251 2HQ 0.9406
252 4ZE 0.9404
253 K2T 0.9403
254 TZC 0.9403
255 I3A 0.9402
256 GAG 0.9400
257 86J 0.9400
258 5OB 0.9400
259 2PC 0.9400
260 J9W 0.9398
261 5M0 0.9397
262 GUN 0.9393
263 AQO 0.9392
264 6M1 0.9392
265 NMJ 0.9391
266 4MA 0.9390
267 MQN 0.9389
268 CTL 0.9389
269 ARB 0.9389
270 OVV 0.9387
271 IGA 0.9387
272 M6N 0.9385
273 275 0.9385
274 XAN 0.9385
275 5VM 0.9384
276 4HO 0.9384
277 SKA 0.9384
278 4NC 0.9381
279 4XR 0.9380
280 HHA 0.9378
281 3ZQ 0.9378
282 XBZ 0.9375
283 A2F 0.9375
284 IT2 0.9375
285 45C 0.9373
286 4YO 0.9373
287 CFP 0.9373
288 273 0.9373
289 JBN 0.9372
290 4HC 0.9367
291 265 0.9366
292 4JQ 0.9365
293 NIZ 0.9363
294 PYD 0.9362
295 ICP 0.9362
296 4JU 0.9361
297 60P 0.9360
298 5AC 0.9359
299 AJ2 0.9355
300 P72 0.9355
301 2MP 0.9353
302 HBA 0.9353
303 290 0.9350
304 NOJ 0.9349
305 2AC 0.9348
306 HH5 0.9348
307 6CS 0.9348
308 3BZ 0.9347
309 C21 0.9346
310 F5B 0.9345
311 6AP 0.9345
312 141 0.9345
313 WCE 0.9343
314 34A 0.9342
315 DX4 0.9341
316 5UC 0.9340
317 FUL 0.9338
318 JA8 0.9336
319 XYD 0.9333
320 HY3 0.9333
321 54D 0.9332
322 0TU 0.9332
323 8H8 0.9328
324 SW7 0.9327
325 4P5 0.9326
326 VNJ 0.9325
327 F4Z 0.9324
328 HZQ 0.9320
329 PY7 0.9320
330 MT0 0.9317
331 MLT 0.9317
332 2MH 0.9317
333 XX2 0.9316
334 A1U 0.9316
335 KT7 0.9315
336 5MH 0.9314
337 495 0.9313
338 KJU 0.9313
339 K34 0.9312
340 BZ3 0.9310
341 6GU 0.9309
342 CFI 0.9309
343 BRT 0.9308
344 3Z8 0.9307
345 174 0.9305
346 PLQ 0.9304
347 RIP 0.9304
348 GYE 0.9302
349 2YU 0.9300
350 3SK 0.9300
351 QOS 0.9299
352 MYJ 0.9299
353 INO 0.9297
354 E7Z 0.9297
355 NNO 0.9297
356 AZ9 0.9297
357 G5V 0.9295
358 5MK 0.9294
359 SX1 0.9294
360 282 0.9294
361 SOE 0.9294
362 HQE 0.9292
363 P9P 0.9289
364 KOJ 0.9289
365 92K 0.9288
366 AZG 0.9286
367 TC7 0.9286
368 9MG 0.9285
369 43M 0.9285
370 0MK 0.9282
371 9TZ 0.9281
372 LG4 0.9281
373 B57 0.9278
374 FHB 0.9278
375 FDB 0.9277
376 4CL 0.9276
377 YH7 0.9275
378 SWA 0.9275
379 2HO 0.9273
380 4AA 0.9271
381 MZG 0.9271
382 HIS 0.9271
383 RSO 0.9270
384 RM1 0.9269
385 HT4 0.9268
386 5RN 0.9266
387 4A3 0.9265
388 BOA 0.9265
389 5JC 0.9265
390 G3F 0.9264
391 FBV 0.9263
392 TM7 0.9263
393 NDH 0.9260
394 FPN 0.9260
395 3OC 0.9258
396 717 0.9258
397 4JJ 0.9256
398 5XC 0.9255
399 3HM 0.9255
400 0R0 0.9254
401 HBX 0.9254
402 I1E 0.9252
403 JLZ 0.9252
404 XIY 0.9251
405 DA1 0.9250
406 PCR 0.9250
407 1XM 0.9249
408 AC6 0.9248
409 SYN 0.9246
410 1DU 0.9246
411 93K 0.9245
412 JZ2 0.9245
413 BCP 0.9240
414 FUC 0.9239
415 0W8 0.9236
416 URC 0.9233
417 24B 0.9233
418 F9P 0.9231
419 SRT 0.9228
420 4VP 0.9228
421 HQD 0.9227
422 FPI 0.9227
423 BTY 0.9225
424 6RQ 0.9224
425 FPY 0.9224
426 SMV 0.9223
427 AMC 0.9223
428 0CU 0.9222
429 25R 0.9222
430 CAQ 0.9221
431 IV2 0.9220
432 5GU 0.9220
433 4JO 0.9218
434 PXY 0.9218
435 0JD 0.9218
436 JZ5 0.9217
437 UNC 0.9213
438 GIO 0.9213
439 EXO 0.9211
440 ABN 0.9210
441 ASO 0.9208
442 M0W 0.9206
443 B53 0.9205
444 9TW 0.9203
445 MR1 0.9202
446 NSP 0.9202
447 OXE 0.9194
448 OK7 0.9193
449 FBM 0.9191
450 1M2 0.9191
451 MWJ 0.9189
452 XXR 0.9188
453 ISE 0.9188
454 LZM 0.9186
455 PHU 0.9184
456 27Y 0.9182
457 CHB 0.9181
458 42A 0.9181
459 40O 0.9181
460 HLZ 0.9180
461 KYD 0.9180
462 MWP 0.9180
463 39A 0.9178
464 JAB 0.9175
465 B60 0.9175
466 0N7 0.9174
467 RAM 0.9174
468 DYA 0.9172
469 MO8 0.9170
470 FB2 0.9170
471 GCS 0.9170
472 PYQ 0.9169
473 BR9 0.9169
474 4Z4 0.9168
475 TPA 0.9168
476 TFB 0.9168
477 RCO 0.9167
478 RMN 0.9165
479 NBE 0.9163
480 7VS 0.9163
481 PYF 0.9158
482 B55 0.9158
483 4ZC 0.9158
484 XBT 0.9158
485 IUR 0.9157
486 M4T 0.9156
487 MAQ 0.9155
488 HMU 0.9155
489 BSX 0.9154
490 8OZ 0.9154
491 BEA 0.9153
492 75K 0.9152
493 14J 0.9152
494 G2F 0.9152
495 MUA 0.9151
496 LSA 0.9150
497 AJV 0.9149
498 PZI 0.9149
499 ZZT 0.9148
500 QSB 0.9146
501 5JQ 0.9144
502 BEW 0.9144
503 FQI 0.9143
504 3CH 0.9143
505 BML 0.9143
506 QBK 0.9142
507 OXC 0.9140
508 MAK 0.9140
509 3IT 0.9140
510 XAZ 0.9137
511 IFL 0.9137
512 DBX 0.9136
513 M1E 0.9135
514 2EC 0.9135
515 64K 0.9135
516 DRL 0.9132
517 9FL 0.9131
518 MS9 0.9129
519 M2K 0.9128
520 82I 0.9127
521 3MC 0.9125
522 ADK 0.9125
523 EKZ 0.9122
524 FCR 0.9122
525 4HS 0.9122
526 FOT 0.9121
527 M0Q 0.9121
528 IDH 0.9120
529 CYT 0.9119
530 JUG 0.9118
531 CRS 0.9118
532 7NI 0.9117
533 URA 0.9117
534 KIV 0.9116
535 8TX 0.9115
536 8S0 0.9115
537 Q6T 0.9114
538 PYG 0.9112
539 XHP 0.9111
540 APZ 0.9110
541 BDP 0.9110
542 44W 0.9109
543 ICO 0.9109
544 LG3 0.9108
545 2CH 0.9107
546 FB1 0.9107
547 TIU 0.9107
548 42C 0.9106
549 JZ0 0.9105
550 4CH 0.9105
551 B62 0.9101
552 J9T 0.9100
553 DE5 0.9099
554 L89 0.9099
555 ECE 0.9098
556 IHB 0.9095
557 JIF 0.9095
558 RHU 0.9095
559 1P3 0.9095
560 PBA 0.9094
561 44V 0.9094
562 FBA 0.9094
563 ASP 0.9094
564 XQG 0.9093
565 R8A 0.9093
566 0FO 0.9092
567 WOT 0.9090
568 M1H 0.9090
569 H8N 0.9090
570 QX2 0.9089
571 2BG 0.9089
572 1AN 0.9088
573 3XX 0.9088
574 51R 0.9087
575 MAE 0.9087
576 PRS 0.9086
577 7MU 0.9086
578 3RK 0.9086
579 284 0.9086
580 3MA 0.9085
581 NQ 0.9085
582 GAL 0.9084
583 KJY 0.9083
584 G1O 0.9083
585 8ZE 0.9083
586 URP 0.9083
587 UY7 0.9082
588 HIO 0.9081
589 PMB 0.9080
590 TLD 0.9079
591 5WX 0.9079
592 OTW 0.9078
593 TOF 0.9078
594 EYK 0.9078
595 RXA 0.9078
596 SHA 0.9078
597 92Z 0.9076
598 93Q 0.9076
599 4JN 0.9074
600 ZBT 0.9074
601 A29 0.9073
602 2AF 0.9071
603 8IG 0.9071
604 ORO 0.9071
605 DFU 0.9071
606 IJZ 0.9069
607 5JL 0.9068
608 FP2 0.9068
609 TEP 0.9067
610 37T 0.9067
611 8LG 0.9067
612 MBD 0.9067
613 15E 0.9066
614 J9Q 0.9065
615 26D 0.9064
616 LG5 0.9064
617 PAC 0.9062
618 FCA 0.9060
619 IPB 0.9060
620 4WL 0.9059
621 FBT 0.9058
622 QWW 0.9058
623 4HM 0.9058
624 3FA 0.9057
625 BVF 0.9057
626 FLM 0.9056
627 DQU 0.9055
628 INS 0.9054
629 2AK 0.9052
630 AKH 0.9051
631 F9Y 0.9051
632 3Z7 0.9051
633 4MU 0.9050
634 76X 0.9050
635 34D 0.9049
636 TLA 0.9047
637 CTS 0.9046
638 TSU 0.9044
639 TAR 0.9043
640 1DQ 0.9043
641 3DO 0.9040
642 HTS 0.9039
643 ABE 0.9039
644 8WT 0.9038
645 NOY 0.9037
646 DIU 0.9037
647 BNS 0.9035
648 SJ5 0.9034
649 P3K 0.9033
650 6NT 0.9033
651 AAS 0.9032
652 DFB 0.9032
653 F81 0.9031
654 MVN 0.9030
655 LMR 0.9030
656 3FH 0.9030
657 SAN 0.9030
658 938 0.9029
659 4JM 0.9029
660 MRZ 0.9029
661 C2U 0.9028
662 VK3 0.9028
663 AW5 0.9027
664 N2I 0.9026
665 PCA 0.9025
666 2H5 0.9024
667 DUC 0.9024
668 FFP 0.9021
669 DBJ 0.9021
670 2FY 0.9021
671 HY1 0.9018
672 0HO 0.9016
673 97T 0.9015
674 QX4 0.9014
675 2C9 0.9013
676 HJP 0.9013
677 2AL 0.9013
678 NDM 0.9011
679 TGX 0.9010
680 9CA 0.9009
681 1DV 0.9009
682 DHK 0.9009
683 286 0.9007
684 Y8I 0.9004
685 PKU 0.9004
686 SKM 0.9004
687 L99 0.9004
688 DPR 0.9001
689 IFP 0.9001
690 1MR 0.9000
691 GMN 0.8996
692 HDH 0.8996
693 5RO 0.8995
694 BMA 0.8995
695 3DM 0.8994
696 YAN 0.8992
697 4ZA 0.8992
698 APG 0.8990
699 XCZ 0.8989
700 GLA 0.8988
701 0HN 0.8987
702 N8Y 0.8984
703 ARA 0.8984
704 HX3 0.8983
705 GCU 0.8983
706 LCN 0.8980
707 261 0.8980
708 GOO 0.8980
709 2MY 0.8979
710 GDE 0.8979
711 VNL 0.8978
712 4JL 0.8978
713 3NY 0.8977
714 DGJ 0.8977
715 AZF 0.8976
716 1IT 0.8975
717 GLL 0.8975
718 RIB 0.8974
719 HFB 0.8973
720 8GF 0.8971
721 IFM 0.8967
722 4J8 0.8967
723 K5W 0.8966
724 23W 0.8965
725 FBW 0.8964
726 9CL 0.8963
727 KDV 0.8961
728 TTY 0.8959
729 3CE 0.8957
730 IOL 0.8957
731 YHO 0.8956
732 6X8 0.8953
733 X0V 0.8952
734 6MH 0.8952
735 JZ1 0.8950
736 KPL 0.8950
737 NK2 0.8950
738 FP1 0.8949
739 E5X 0.8949
740 9KT 0.8946
741 2ZM 0.8946
742 MZW 0.8946
743 MNM 0.8944
744 CFF 0.8943
745 ALL 0.8942
746 F0J 0.8940
747 HYP 0.8940
748 PEA 0.8940
749 AKG 0.8938
750 DUB 0.8936
751 BCU 0.8936
752 7MH 0.8936
753 MAN 0.8935
754 I1N 0.8935
755 LGC 0.8934
756 JXN 0.8932
757 5NI 0.8932
758 DTL 0.8932
759 DOR 0.8930
760 APY 0.8929
761 WOO 0.8927
762 HSO 0.8925
763 ABI 0.8924
764 HSE 0.8923
765 C2B 0.8921
766 2ZQ 0.8920
767 HGQ 0.8920
768 6ME 0.8919
769 9TY 0.8919
770 2HU 0.8918
771 7N0 0.8916
772 23J 0.8914
773 YTB 0.8914
774 GAF 0.8914
775 OVM 0.8909
776 MNN 0.8909
777 DHR 0.8909
778 OXZ 0.8909
779 7ZE 0.8908
780 MXN 0.8908
781 TMZ 0.8908
782 FBS 0.8908
783 280 0.8908
784 1DJ 0.8907
785 GZL 0.8907
786 PA1 0.8905
787 VAL 0.8905
788 4FA 0.8905
789 2CM 0.8903
790 B3R 0.8902
791 7WG 0.8901
792 8WO 0.8900
793 9RW 0.8896
794 SXS 0.8896
795 4XX 0.8896
796 TEO 0.8896
797 Z6J 0.8895
798 JFD 0.8894
799 PNZ 0.8894
800 1LN 0.8892
801 T6C 0.8892
802 CWJ 0.8891
803 CIG 0.8890
804 X05 0.8890
805 F31 0.8890
806 D1X 0.8889
807 XYL 0.8888
808 RB5 0.8888
809 PIM 0.8887
810 DQN 0.8885
811 XUL 0.8885
812 CXF 0.8882
813 285 0.8880
814 TM4 0.8878
815 CN0 0.8878
816 6NI 0.8878
817 ANN 0.8875
818 PIY 0.8875
819 MLA 0.8873
820 GVG 0.8873
821 CLZ 0.8872
822 069 0.8871
823 3MB 0.8870
824 1F1 0.8870
825 1XX 0.8870
826 0FN 0.8870
827 9R5 0.8870
828 AFR 0.8869
829 ASC 0.8869
830 35C 0.8869
831 2FQ 0.8867
832 YSO 0.8866
833 4BZ 0.8866
834 4NM 0.8865
835 ODO 0.8865
836 PHT 0.8864
837 2LP 0.8864
838 149 0.8864
839 2A9 0.8863
840 94W 0.8862
841 3A9 0.8861
842 HEW 0.8861
843 UEG 0.8860
844 7VJ 0.8860
845 PFB 0.8859
846 3SL 0.8859
847 LDU 0.8859
848 URQ 0.8858
849 OHG 0.8858
850 39O 0.8857
851 ICC 0.8857
852 AEF 0.8857
853 12B 0.8856
854 PAF 0.8856
855 IF7 0.8856
856 IP0 0.8856
857 LDP 0.8856
858 4H2 0.8855
859 FGZ 0.8855
860 BCF 0.8853
861 NTM 0.8852
862 EUG 0.8852
863 7ME 0.8851
864 3MH 0.8851
865 A09 0.8851
866 RM4 0.8850
867 2A7 0.8845
868 M3T 0.8844
869 4FH 0.8843
870 B24 0.8843
871 R8S 0.8842
872 GTR 0.8842
873 PQ0 0.8841
874 5CL 0.8841
875 INE 0.8841
876 EVA 0.8841
877 QSH 0.8840
878 OTR 0.8840
879 PCI 0.8839
880 IBF 0.8838
881 SS2 0.8836
882 PYJ 0.8836
883 R9Y 0.8836
884 KBG 0.8835
885 NEQ 0.8835
886 V55 0.8834
887 4SX 0.8834
888 A13 0.8833
889 6VD 0.8833
890 1SA 0.8830
891 259 0.8827
892 6HQ 0.8827
893 FPK 0.8827
894 H3M 0.8827
895 GXY 0.8826
896 FUF 0.8826
897 HQJ 0.8825
898 KLW 0.8824
899 DPZ 0.8823
900 JAW 0.8823
901 1U6 0.8821
902 HSM 0.8820
903 JND 0.8818
904 TMT 0.8818
905 4TU 0.8817
906 HPY 0.8817
907 GIF 0.8816
908 RNS 0.8816
909 SHG 0.8815
910 5WY 0.8814
911 NID 0.8813
912 LI6 0.8813
913 X6X 0.8813
914 PHE 0.8812
915 2XX 0.8811
916 M6W 0.8811
917 M3H 0.8810
918 BBF 0.8810
919 SMN 0.8808
920 BPN 0.8805
921 DMG 0.8805
922 TBS 0.8804
923 XRG 0.8804
924 3R6 0.8803
925 LKA 0.8803
926 45L 0.8802
927 R2B 0.8801
928 FLA 0.8801
929 4M4 0.8799
930 DIE 0.8799
931 C5J 0.8799
932 G4D 0.8797
933 ALO 0.8795
934 FCB 0.8794
935 PRF 0.8793
936 GIV 0.8792
937 TSS 0.8791
938 PBE 0.8789
939 SIN 0.8788
940 2DR 0.8787
941 AGK 0.8785
942 OVP 0.8784
943 MLI 0.8784
944 IPH 0.8784
945 PXM 0.8782
946 NCT 0.8782
947 F3B 0.8779
948 S76 0.8779
949 4ME 0.8779
950 C2A 0.8777
951 FA1 0.8777
952 PEL 0.8775
953 329 0.8775
954 P2D 0.8774
955 ZVO 0.8772
956 MZB 0.8772
957 KBB 0.8770
958 AL0 0.8769
959 YRL 0.8768
960 XXP 0.8768
961 SVD 0.8766
962 BZ2 0.8765
963 GLF 0.8764
964 K17 0.8763
965 TYL 0.8761
966 BP9 0.8761
967 OW4 0.8761
968 2FG 0.8761
969 MBN 0.8760
970 1AB 0.8759
971 BDF 0.8756
972 PRZ 0.8754
973 PHH 0.8753
974 PZM 0.8753
975 DS0 0.8752
976 QMP 0.8750
977 GXL 0.8750
978 GXE 0.8750
979 GLU 0.8748
980 MFB 0.8747
981 FBJ 0.8746
982 1KP 0.8745
983 D07 0.8745
984 QY9 0.8744
985 E7S 0.8744
986 HHQ 0.8743
987 260 0.8741
988 DMJ 0.8740
989 X09 0.8740
990 PEY 0.8740
991 3AP 0.8740
992 95Z 0.8740
993 HXX 0.8734
994 FUM 0.8734
995 YIO 0.8733
996 SRO 0.8732
997 PEP 0.8732
998 SN4 0.8732
999 QPR 0.8729
1000 NVI 0.8728
1001 SOR 0.8728
1002 THR 0.8726
1003 52C 0.8726
1004 RPQ 0.8725
1005 L5V 0.8724
1006 2AP 0.8724
1007 ADA 0.8722
1008 M2H 0.8720
1009 ASN 0.8718
1010 680 0.8717
1011 J6W 0.8716
1012 HRZ 0.8716
1013 1GN 0.8715
1014 COI 0.8714
1015 47J 0.8714
1016 DNF 0.8713
1017 GJS 0.8712
1018 6LW 0.8712
1019 4AP 0.8712
1020 GCB 0.8711
1021 ZXD 0.8711
1022 GOJ 0.8708
1023 JG8 0.8707
1024 9PO 0.8705
1025 DHS 0.8704
1026 0F9 0.8704
1027 TBP 0.8700
1028 HVK 0.8700
1029 92P 0.8698
1030 7B3 0.8697
1031 CEJ 0.8696
1032 9X7 0.8695
1033 ITN 0.8695
1034 LNR 0.8692
1035 2KT 0.8692
1036 CRN 0.8691
1037 JB8 0.8688
1038 UAN 0.8688
1039 JDN 0.8687
1040 H33 0.8685
1041 MSN 0.8684
1042 209 0.8683
1043 J9N 0.8683
1044 EN1 0.8683
1045 OA3 0.8680
1046 AJY 0.8677
1047 ESP 0.8677
1048 8CL 0.8677
1049 15N 0.8676
1050 SEP 0.8675
1051 FDK 0.8675
1052 LGA 0.8673
1053 94N 0.8670
1054 C2Y 0.8669
1055 Z5P 0.8662
1056 25T 0.8662
1057 ICB 0.8659
1058 K8X 0.8658
1059 4P0 0.8657
1060 BVC 0.8655
1061 B5D 0.8654
1062 IWT 0.8649
1063 LYL 0.8649
1064 SYG 0.8648
1065 Q7A 0.8644
1066 Q02 0.8644
1067 0OC 0.8641
1068 SPV 0.8640
1069 TT4 0.8640
1070 HCS 0.8637
1071 AHB 0.8637
1072 8W9 0.8635
1073 6UA 0.8634
1074 40E 0.8633
1075 3PY 0.8632
1076 UFV 0.8628
1077 0LH 0.8626
1078 CGB 0.8626
1079 BR8 0.8624
1080 XLS 0.8623
1081 TZF 0.8618
1082 E1T 0.8617
1083 13X 0.8617
1084 PDC 0.8616
1085 6FZ 0.8613
1086 AAE 0.8613
1087 GJZ 0.8613
1088 4XV 0.8610
1089 DEE 0.8608
1090 FH2 0.8602
1091 F12 0.8602
1092 0BP 0.8599
1093 JXW 0.8597
1094 KG7 0.8596
1095 ZYR 0.8595
1096 ZWZ 0.8594
1097 8K2 0.8593
1098 948 0.8591
1099 24T 0.8589
1100 QAS 0.8585
1101 PH2 0.8583
1102 TZE 0.8581
1103 VOH 0.8581
1104 ZZ3 0.8575
1105 3AY 0.8574
1106 WDL 0.8572
1107 ICF 0.8567
1108 AX2 0.8561
1109 O7U 0.8559
1110 FDR 0.8556
1111 PRY 0.8555
1112 SNU 0.8554
1113 FBU 0.8551
1114 2FT 0.8549
1115 HHR 0.8544
1116 GLT 0.8530
1117 RJY 0.8524
1118 5AN 0.8519
1119 2MN 0.8513
1120 MT5 0.8510
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 6W0Z; Ligand: S6D; 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: 6w0z.bio1) has 40 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 6W0Z; Ligand: S6D; 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: 6w0z.bio1) has 22 residues
No: Leader PDB Ligand Sequence Similarity
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