Receptor
PDB id Resolution Class Description Source Keywords
2Z94 1.78 Å EC: 3.4.22.69 COMPLEX STRUCTURE OF SARS-COV 3C-LIKE PROTEASE WITH TDT SARS CORONAVIRUS COMPLEX HYDROLASE
Ref.: STRUCTURAL BASIS OF MERCURY- AND ZINC-CONJUGATED COMPLEXES AS SARS-COV 3C-LIKE PROTEASE INHIBITORS FEBS LETT. V. 581 5454 2007
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
TLD A:902;
 Valid;
 none;
 submit data
156.268 C7 H8 S2 Cc1cc...
ZN A:901;
 Part of Protein;
 none;
 submit data
65.409 Zn [Zn+2...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
3AVZ 2.46 Å EC: 3.4.22.69 STRUCTURE OF SARS 3CL PROTEASE WITH PEPTIDIC ALDEHYDE INHIBI CONTAINING CYCLOHEXYL SIDE CHAIN SARS CORONAVIRUS HYDROLASE PROTEINASE CONVERTING DESIGNED INHIBITOR HYDROLAHYDROLASE INHIBITOR COMPLEX
Ref.: STRUCTURE-BASED DESIGN, SYNTHESIS, AND EVALUATION O PEPTIDE-MIMETIC SARS 3CL PROTEASE INHIBITORS. J.MED.CHEM. V. 54 7962 2011
Members (13)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 4TWW ic50 = 63 uM 3A7 C23 H29 Br N4 O2 c1cc(ccc1C....
2 4WY3 ic50 = 240 uM 3X5 C29 H34 N4 O2 c1ccc(cc1)....
3 3AW0 ic50 = 5.7 uM ACE SER ALA VAL LEU HSV n/a n/a
4 2GZ7 ic50 = 0.3 uM D3F C14 H7 Cl2 F3 N2 O6 S Cc1cc(c(cc....
5 4MDS ic50 = 6.2 uM 23H C28 H33 N7 O3 CCC(C)(C)N....
6 2QIQ ic50 = 80 uM CYV C32 H54 N4 O9 CCOC(=O)CC....
7 6M2N Kd = 4.03 uM 3WL C15 H10 O5 c1ccc(cc1)....
8 3V3M ic50 = 4.8 uM 0EN C26 H31 N3 O3 CC(C)(C)c1....
9 3AVZ ic50 = 65 nM ACE SER ALA VAL ALC HSV n/a n/a
10 2Z94 - TLD C7 H8 S2 Cc1ccc(c(c....
11 3ATW ic50 = 98 nM ACE THR VAL ALC HSV n/a n/a
12 2GZ8 ic50 = 3 uM F3F C16 H8 F3 N3 O2 S c1ccc(cc1)....
13 1UK4 - ASN SER THR LEU GLN n/a n/a
70% Homology Family (13)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 4TWW ic50 = 63 uM 3A7 C23 H29 Br N4 O2 c1cc(ccc1C....
2 4WY3 ic50 = 240 uM 3X5 C29 H34 N4 O2 c1ccc(cc1)....
3 3AW0 ic50 = 5.7 uM ACE SER ALA VAL LEU HSV n/a n/a
4 2GZ7 ic50 = 0.3 uM D3F C14 H7 Cl2 F3 N2 O6 S Cc1cc(c(cc....
5 4MDS ic50 = 6.2 uM 23H C28 H33 N7 O3 CCC(C)(C)N....
6 2QIQ ic50 = 80 uM CYV C32 H54 N4 O9 CCOC(=O)CC....
7 6M2N Kd = 4.03 uM 3WL C15 H10 O5 c1ccc(cc1)....
8 3V3M ic50 = 4.8 uM 0EN C26 H31 N3 O3 CC(C)(C)c1....
9 3AVZ ic50 = 65 nM ACE SER ALA VAL ALC HSV n/a n/a
10 2Z94 - TLD C7 H8 S2 Cc1ccc(c(c....
11 3ATW ic50 = 98 nM ACE THR VAL ALC HSV n/a n/a
12 2GZ8 ic50 = 3 uM F3F C16 H8 F3 N3 O2 S c1ccc(cc1)....
13 1UK4 - ASN SER THR LEU GLN n/a n/a
50% Homology Family (18)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 4TWW ic50 = 63 uM 3A7 C23 H29 Br N4 O2 c1cc(ccc1C....
2 4WY3 ic50 = 240 uM 3X5 C29 H34 N4 O2 c1ccc(cc1)....
3 3AW0 ic50 = 5.7 uM ACE SER ALA VAL LEU HSV n/a n/a
4 2GZ7 ic50 = 0.3 uM D3F C14 H7 Cl2 F3 N2 O6 S Cc1cc(c(cc....
5 4MDS ic50 = 6.2 uM 23H C28 H33 N7 O3 CCC(C)(C)N....
6 2QIQ ic50 = 80 uM CYV C32 H54 N4 O9 CCOC(=O)CC....
7 6M2N Kd = 4.03 uM 3WL C15 H10 O5 c1ccc(cc1)....
8 3V3M ic50 = 4.8 uM 0EN C26 H31 N3 O3 CC(C)(C)c1....
9 3AVZ ic50 = 65 nM ACE SER ALA VAL ALC HSV n/a n/a
10 2Z94 - TLD C7 H8 S2 Cc1ccc(c(c....
11 3ATW ic50 = 98 nM ACE THR VAL ALC HSV n/a n/a
12 2GZ8 ic50 = 3 uM F3F C16 H8 F3 N3 O2 S c1ccc(cc1)....
13 1UK4 - ASN SER THR LEU GLN n/a n/a
14 4YLU - R30 C22 H21 N5 O2 S CCC(=O)Nc1....
15 4YOG ic50 = 1.8 uM 4F5 C26 H28 N6 O3 S CC(=O)Nc1c....
16 4YOI ic50 = 0.33 uM 4F4 C24 H19 N5 O2 S2 c1ccc2c(c1....
17 4YOJ ic50 = 0.41 uM RFM C26 H21 N5 O2 S c1ccc(cc1)....
18 2ZU2 - DTZ H2 S2 Zn S[Zn]S
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: TLD; Similar ligands found: 2
No: Ligand ECFP6 Tc MDL keys Tc
1 TLD 1 1
2 HT4 0.482759 0.7
Similar Ligands (3D)
Ligand no: 1; Ligand: TLD; Similar ligands found: 910
No: Ligand Similarity coefficient
1 TH0 0.9997
2 43M 0.9992
3 2MP 0.9971
4 34A 0.9965
5 4JO 0.9961
6 275 0.9929
7 5UC 0.9916
8 5JC 0.9914
9 5MH 0.9913
10 TM7 0.9912
11 2YU 0.9907
12 XYD 0.9905
13 JZ2 0.9898
14 MWM 0.9897
15 XBZ 0.9897
16 Y8I 0.9892
17 PYD 0.9888
18 ICP 0.9886
19 A1U 0.9883
20 4ZE 0.9880
21 TDR 0.9878
22 MCT 0.9874
23 2AC 0.9873
24 MWJ 0.9866
25 1MC 0.9865
26 MZG 0.9864
27 QOS 0.9859
28 4JJ 0.9855
29 URF 0.9848
30 IUR 0.9837
31 BR9 0.9816
32 4CL 0.9800
33 27Y 0.9781
34 WBU 0.9777
35 4HO 0.9764
36 LXC 0.9756
37 XYP 0.9735
38 3Z7 0.9735
39 HMH 0.9720
40 IDH 0.9682
41 3ZQ 0.9676
42 4JU 0.9672
43 AHR 0.9664
44 HX3 0.9649
45 TC7 0.9642
46 8H8 0.9629
47 4XR 0.9629
48 F4Z 0.9619
49 45C 0.9618
50 1DW 0.9600
51 2CQ 0.9594
52 OXE 0.9591
53 ZZT 0.9591
54 FYU 0.9589
55 4ZC 0.9583
56 24B 0.9581
57 40O 0.9580
58 284 0.9577
59 NSP 0.9576
60 2MH 0.9576
61 RCO 0.9572
62 T6C 0.9569
63 CRS 0.9567
64 150 0.9551
65 2CH 0.9551
66 JFD 0.9548
67 PXY 0.9544
68 XYS 0.9542
69 35C 0.9541
70 4CH 0.9541
71 URA 0.9535
72 BEW 0.9529
73 YAN 0.9527
74 285 0.9524
75 B3R 0.9519
76 CAQ 0.9518
77 LG3 0.9518
78 PCR 0.9517
79 25R 0.9509
80 FPY 0.9508
81 HQE 0.9507
82 26D 0.9506
83 HTS 0.9505
84 LG5 0.9505
85 M3T 0.9504
86 CYT 0.9501
87 7CZ 0.9501
88 1WG 0.9500
89 3CH 0.9500
90 2AF 0.9495
91 4H2 0.9489
92 RIP 0.9489
93 1PT 0.9485
94 L89 0.9485
95 BML 0.9480
96 4JN 0.9480
97 HMU 0.9479
98 BVF 0.9474
99 938 0.9471
100 PLQ 0.9470
101 7MH 0.9469
102 HEW 0.9468
103 CIG 0.9466
104 JZ0 0.9464
105 8GF 0.9464
106 ARB 0.9459
107 0MK 0.9455
108 FUL 0.9455
109 LG4 0.9454
110 6X8 0.9453
111 IOL 0.9444
112 FPN 0.9439
113 TBP 0.9439
114 92Z 0.9438
115 FUC 0.9435
116 G6D 0.9431
117 KOJ 0.9430
118 4HS 0.9428
119 DA1 0.9426
120 JZ3 0.9423
121 FP2 0.9422
122 TH7 0.9421
123 1AN 0.9419
124 JIF 0.9412
125 DFU 0.9412
126 JAE 0.9409
127 8LG 0.9409
128 NK 0.9408
129 HGQ 0.9408
130 93Q 0.9400
131 TMZ 0.9391
132 0TR 0.9390
133 0R0 0.9388
134 76X 0.9382
135 HHQ 0.9378
136 25W 0.9378
137 RSF 0.9370
138 FCA 0.9360
139 HBA 0.9360
140 TMT 0.9357
141 3XX 0.9345
142 GLC 0.9334
143 DUC 0.9332
144 F0J 0.9332
145 4M4 0.9330
146 4XX 0.9329
147 SWD 0.9328
148 V55 0.9326
149 H3M 0.9325
150 XXR 0.9321
151 ES4 0.9313
152 ADE 0.9309
153 F81 0.9308
154 BTE 0.9305
155 4JL 0.9305
156 PM6 0.9300
157 C2B 0.9296
158 PHB 0.9290
159 CYH 0.9285
160 6MP 0.9282
161 HPA 0.9282
162 PYG 0.9281
163 IT2 0.9277
164 BZX 0.9273
165 10L 0.9272
166 1XX 0.9270
167 DTL 0.9266
168 BP1 0.9264
169 23A 0.9263
170 DUB 0.9262
171 QWN 0.9261
172 7WA 0.9259
173 CXL 0.9258
174 286 0.9256
175 HAI 0.9252
176 M1A 0.9250
177 7W4 0.9249
178 C2A 0.9249
179 9DA 0.9244
180 DFB 0.9244
181 6AI 0.9243
182 4VP 0.9239
183 9HX 0.9237
184 7HP 0.9234
185 SVN 0.9233
186 2DR 0.9233
187 ABE 0.9229
188 6M9 0.9223
189 KKN 0.9223
190 2MY 0.9220
191 FPI 0.9220
192 CWM 0.9219
193 J1Z 0.9219
194 M2H 0.9219
195 AMC 0.9214
196 9EW 0.9214
197 GBD 0.9214
198 SOE 0.9213
199 ES0 0.9211
200 MBD 0.9211
201 G2F 0.9207
202 BZI 0.9207
203 QXW 0.9207
204 0RW 0.9206
205 DEN 0.9204
206 282 0.9203
207 14O 0.9201
208 XQ0 0.9201
209 2D0 0.9201
210 ISN 0.9200
211 Q88 0.9199
212 6MH 0.9199
213 B53 0.9198
214 4HM 0.9198
215 H8N 0.9196
216 3FA 0.9195
217 ADZ 0.9194
218 5H1 0.9193
219 F05 0.9192
220 3MC 0.9191
221 FK1 0.9191
222 67N 0.9191
223 F60 0.9191
224 DGJ 0.9190
225 23W 0.9188
226 2A9 0.9187
227 1P7 0.9186
228 NOJ 0.9186
229 BGC 0.9184
230 2C9 0.9184
231 HLR 0.9184
232 ES7 0.9182
233 NOY 0.9181
234 5MI 0.9180
235 5CL 0.9180
236 GMN 0.9180
237 EXO 0.9179
238 BZF 0.9177
239 AX2 0.9176
240 GYE 0.9174
241 GVH 0.9173
242 5MB 0.9172
243 IND 0.9172
244 64K 0.9172
245 MLT 0.9170
246 ECE 0.9170
247 GAG 0.9169
248 4JP 0.9169
249 2CM 0.9168
250 11S 0.9168
251 H4N 0.9168
252 ES9 0.9167
253 7B4 0.9166
254 NBZ 0.9164
255 EUG 0.9162
256 HBX 0.9158
257 BEZ 0.9158
258 6M4 0.9158
259 JZ1 0.9157
260 5WV 0.9156
261 13X 0.9155
262 G4D 0.9155
263 RAM 0.9154
264 IFL 0.9152
265 R8A 0.9152
266 R8S 0.9150
267 DTU 0.9149
268 HPY 0.9149
269 3CE 0.9149
270 82I 0.9149
271 M58 0.9149
272 FUF 0.9148
273 5AN 0.9147
274 270 0.9147
275 0R1 0.9145
276 SAL 0.9144
277 0CT 0.9144
278 FCB 0.9143
279 G3F 0.9142
280 12M 0.9142
281 5ZE 0.9142
282 DMD 0.9141
283 RIB 0.9141
284 KIV 0.9141
285 3DM 0.9139
286 IPH 0.9138
287 9TZ 0.9138
288 FLM 0.9138
289 MPI 0.9138
290 SMV 0.9137
291 6UA 0.9136
292 LZ1 0.9135
293 P9P 0.9134
294 94N 0.9132
295 FBA 0.9132
296 2K4 0.9132
297 2ZX 0.9131
298 AX7 0.9131
299 60P 0.9130
300 3MH 0.9130
301 280 0.9129
302 TM4 0.9128
303 P92 0.9127
304 NCA 0.9124
305 6CS 0.9124
306 5AC 0.9123
307 XBT 0.9123
308 HY3 0.9122
309 BR8 0.9122
310 4M0 0.9122
311 FA0 0.9122
312 JBE 0.9121
313 GTQ 0.9121
314 YCP 0.9119
315 GAL 0.9119
316 ERH 0.9119
317 OXQ 0.9119
318 3U4 0.9117
319 4FS 0.9117
320 SYN 0.9117
321 3AY 0.9116
322 ABV 0.9116
323 03V 0.9114
324 PXM 0.9114
325 1DH 0.9111
326 4CS 0.9109
327 9DG 0.9109
328 5B1 0.9109
329 4XH 0.9109
330 HH8 0.9109
331 ABN 0.9108
332 CHB 0.9107
333 2MI 0.9107
334 4JM 0.9107
335 MNM 0.9106
336 WDL 0.9105
337 IDM 0.9105
338 YHO 0.9104
339 XM0 0.9104
340 8S0 0.9104
341 ES5 0.9103
342 MBN 0.9103
343 MYJ 0.9102
344 GCS 0.9101
345 265 0.9101
346 BE2 0.9101
347 2AQ 0.9100
348 TCZ 0.9099
349 FFP 0.9099
350 BCP 0.9099
351 9X7 0.9099
352 PXL 0.9099
353 GXY 0.9098
354 JAB 0.9097
355 4SV 0.9097
356 ICC 0.9097
357 24T 0.9096
358 A2Q 0.9096
359 HIU 0.9095
360 ES6 0.9095
361 3RK 0.9093
362 JB5 0.9092
363 24W 0.9091
364 5NU 0.9090
365 3M0 0.9090
366 5Q0 0.9090
367 5IQ 0.9090
368 1LM 0.9090
369 9TW 0.9089
370 DOB 0.9088
371 COU 0.9087
372 MAK 0.9086
373 BEN 0.9086
374 GXE 0.9085
375 BHA 0.9085
376 25T 0.9084
377 ES1 0.9082
378 5SG 0.9080
379 LMR 0.9080
380 6HQ 0.9080
381 P3K 0.9079
382 QUZ 0.9079
383 RM4 0.9078
384 IFM 0.9078
385 1NP 0.9077
386 F5B 0.9077
387 OHG 0.9075
388 3F0 0.9075
389 HQY 0.9075
390 1SQ 0.9075
391 S76 0.9074
392 DGY 0.9074
393 1LQ 0.9073
394 7VJ 0.9073
395 AZF 0.9071
396 DBH 0.9071
397 O72 0.9070
398 YTB 0.9070
399 5CU 0.9069
400 R2B 0.9068
401 OAA 0.9067
402 WOT 0.9067
403 4NC 0.9067
404 8NY 0.9067
405 TP5 0.9066
406 4YS 0.9065
407 DTI 0.9065
408 UEG 0.9065
409 JBH 0.9064
410 5RG 0.9064
411 3HA 0.9064
412 0W8 0.9062
413 OCH 0.9061
414 PBC 0.9060
415 5M0 0.9059
416 54G 0.9059
417 GUN 0.9058
418 JPZ 0.9058
419 HVK 0.9057
420 3DO 0.9056
421 93K 0.9055
422 47J 0.9055
423 HRZ 0.9055
424 FQI 0.9051
425 OXZ 0.9050
426 PYF 0.9049
427 TZC 0.9048
428 3AP 0.9048
429 9PO 0.9048
430 XAN 0.9046
431 N5J 0.9046
432 NPY 0.9045
433 2AP 0.9045
434 CYS 0.9045
435 SS1 0.9044
436 8CL 0.9044
437 IPB 0.9044
438 PZA 0.9044
439 3HM 0.9043
440 KSW 0.9043
441 6PC 0.9042
442 H42 0.9041
443 PY7 0.9041
444 DHB 0.9040
445 3ID 0.9040
446 AZA 0.9038
447 6LW 0.9038
448 4AP 0.9037
449 BP9 0.9036
450 MFB 0.9035
451 1WD 0.9034
452 QSC 0.9030
453 KG7 0.9029
454 JLZ 0.9028
455 BOA 0.9027
456 PRO 0.9025
457 VAL 0.9025
458 VGL 0.9025
459 XX2 0.9024
460 RNS 0.9024
461 2IM 0.9023
462 NTN 0.9022
463 MMZ 0.9022
464 HSE 0.9021
465 LGA 0.9021
466 ASO 0.9020
467 YIO 0.9020
468 BAM 0.9019
469 JZ9 0.9018
470 MB3 0.9017
471 1MR 0.9017
472 3HB 0.9015
473 7EX 0.9014
474 1AB 0.9013
475 SX1 0.9013
476 H76 0.9011
477 FOA 0.9010
478 EDG 0.9010
479 2HO 0.9009
480 5MK 0.9007
481 14J 0.9005
482 DX4 0.9005
483 4A3 0.9003
484 6GU 0.9002
485 IHB 0.9002
486 FDB 0.9002
487 1XM 0.9001
488 2CK 0.9001
489 NEQ 0.9000
490 WCE 0.8999
491 JKE 0.8998
492 UNU 0.8996
493 NPO 0.8995
494 KJY 0.8995
495 36R 0.8995
496 JBN 0.8995
497 A2F 0.8994
498 IGA 0.8992
499 NNO 0.8990
500 8GC 0.8989
501 E60 0.8988
502 GOO 0.8988
503 2XX 0.8987
504 URC 0.8987
505 ARA 0.8986
506 2PC 0.8986
507 V1L 0.8985
508 7HQ 0.8984
509 PYC 0.8984
510 2KT 0.8983
511 0CU 0.8983
512 JFJ 0.8983
513 M1E 0.8982
514 FHB 0.8980
515 NIO 0.8979
516 ADK 0.8979
517 3NT 0.8978
518 B55 0.8976
519 CEJ 0.8975
520 DSN 0.8974
521 DMG 0.8974
522 5VM 0.8973
523 TTO 0.8972
524 TAR 0.8970
525 290 0.8969
526 XAZ 0.8968
527 141 0.8967
528 3PY 0.8967
529 K2T 0.8967
530 YH7 0.8966
531 2A7 0.8965
532 LDU 0.8964
533 VGD 0.8963
534 VNL 0.8962
535 BHO 0.8961
536 HH5 0.8960
537 DXX 0.8959
538 7WV 0.8958
539 XQG 0.8958
540 CLW 0.8956
541 RP7 0.8954
542 MRY 0.8953
543 CFP 0.8952
544 QWW 0.8951
545 AC0 0.8950
546 3SK 0.8950
547 WOO 0.8950
548 2EC 0.8949
549 Z82 0.8949
550 FRU 0.8948
551 VOH 0.8947
552 I3A 0.8947
553 0P6 0.8947
554 LGC 0.8944
555 ET2 0.8941
556 ISE 0.8941
557 MZW 0.8940
558 BTY 0.8940
559 INO 0.8939
560 PIH 0.8939
561 QX2 0.8938
562 KT7 0.8938
563 HHN 0.8938
564 273 0.8937
565 6AP 0.8936
566 3BZ 0.8933
567 RM1 0.8933
568 75K 0.8932
569 PYJ 0.8931
570 3AB 0.8930
571 XRG 0.8928
572 ZBT 0.8926
573 1P8 0.8925
574 X6X 0.8925
575 HYN 0.8923
576 IF7 0.8920
577 5HN 0.8919
578 APY 0.8919
579 CIZ 0.8917
580 DIE 0.8917
581 FBB 0.8916
582 DAB 0.8915
583 GAB 0.8915
584 HSL 0.8915
585 C21 0.8913
586 GLA 0.8913
587 INS 0.8911
588 8TX 0.8909
589 KUF 0.8908
590 2H5 0.8908
591 LCN 0.8907
592 260 0.8907
593 278 0.8907
594 AZG 0.8906
595 2FG 0.8905
596 86J 0.8905
597 53C 0.8904
598 42J 0.8903
599 8WO 0.8901
600 717 0.8900
601 HGW 0.8900
602 OVV 0.8900
603 HHA 0.8900
604 CWS 0.8899
605 ALL 0.8898
606 PCA 0.8898
607 8CM 0.8898
608 NMJ 0.8898
609 EQT 0.8896
610 1XN 0.8896
611 GIV 0.8893
612 ALO 0.8892
613 A65 0.8892
614 PAF 0.8890
615 SER 0.8889
616 93B 0.8888
617 MLI 0.8888
618 149 0.8888
619 42A 0.8887
620 GIO 0.8885
621 DRL 0.8885
622 8IG 0.8885
623 4AA 0.8885
624 PAB 0.8884
625 4MA 0.8884
626 CRN 0.8884
627 MAE 0.8882
628 L3Q 0.8881
629 LRH 0.8880
630 5XC 0.8877
631 DHK 0.8877
632 JBK 0.8876
633 PZM 0.8876
634 MO8 0.8875
635 9MG 0.8875
636 ES2 0.8875
637 BRT 0.8874
638 B57 0.8874
639 GXL 0.8874
640 URP 0.8872
641 MLA 0.8868
642 261 0.8868
643 HBD 0.8868
644 C5J 0.8868
645 VNJ 0.8867
646 5JQ 0.8865
647 3MA 0.8863
648 AGK 0.8863
649 SWA 0.8863
650 FP1 0.8860
651 826 0.8859
652 NBE 0.8859
653 L60 0.8859
654 NIZ 0.8859
655 1GN 0.8859
656 SW7 0.8858
657 5JL 0.8857
658 BSX 0.8857
659 BMA 0.8855
660 DMI 0.8852
661 QBK 0.8852
662 AC6 0.8852
663 MBG 0.8851
664 KYD 0.8851
665 E7Z 0.8851
666 ZZ3 0.8850
667 P72 0.8849
668 LDP 0.8849
669 RSO 0.8849
670 M1Q 0.8847
671 9TY 0.8847
672 HXX 0.8846
673 ASN 0.8845
674 XIX 0.8845
675 PZI 0.8844
676 LZM 0.8841
677 NVI 0.8841
678 PA1 0.8840
679 FPK 0.8840
680 PBZ 0.8840
681 FAN 0.8839
682 DIU 0.8839
683 TFB 0.8839
684 SKA 0.8835
685 XUL 0.8835
686 C2U 0.8833
687 MR1 0.8833
688 1P3 0.8831
689 PCI 0.8830
690 HJP 0.8830
691 URQ 0.8830
692 ASP 0.8827
693 M6N 0.8826
694 4Z4 0.8825
695 O7U 0.8824
696 MSN 0.8824
697 1Y6 0.8823
698 MEW 0.8822
699 2HQ 0.8821
700 5OB 0.8820
701 39A 0.8818
702 KBG 0.8818
703 GIF 0.8817
704 UNC 0.8815
705 GAF 0.8814
706 AJ2 0.8814
707 SHG 0.8812
708 BDP 0.8812
709 Q24 0.8809
710 7W1 0.8805
711 PKU 0.8804
712 THR 0.8801
713 BZ3 0.8801
714 9CL 0.8798
715 SEJ 0.8798
716 M5K 0.8797
717 Z6J 0.8794
718 HQT 0.8794
719 A7W 0.8794
720 ABA 0.8793
721 FOT 0.8793
722 F3B 0.8792
723 174 0.8792
724 GRE 0.8792
725 9YL 0.8791
726 TTL 0.8791
727 PE0 0.8788
728 DIN 0.8788
729 32X 0.8785
730 3Z8 0.8785
731 IP0 0.8785
732 AZ8 0.8782
733 BBF 0.8780
734 5QX 0.8779
735 6F0 0.8776
736 BCF 0.8775
737 KJH 0.8773
738 P2D 0.8773
739 DQN 0.8772
740 R8V 0.8772
741 12Q 0.8771
742 KIB 0.8770
743 LER 0.8769
744 69O 0.8768
745 MRW 0.8768
746 J9W 0.8765
747 ISZ 0.8763
748 XIY 0.8763
749 4FA 0.8762
750 AQO 0.8760
751 DYA 0.8759
752 2ZV 0.8757
753 F31 0.8756
754 2LP 0.8756
755 CGB 0.8754
756 4JT 0.8750
757 M0Q 0.8748
758 IBF 0.8747
759 IJZ 0.8745
760 PBR 0.8742
761 EKZ 0.8742
762 B24 0.8741
763 IV2 0.8740
764 XYL 0.8740
765 G5V 0.8739
766 ORO 0.8738
767 7WG 0.8737
768 BVC 0.8735
769 3MG 0.8731
770 M1H 0.8731
771 AAE 0.8731
772 4PW 0.8730
773 TIU 0.8727
774 M0W 0.8727
775 MAN 0.8724
776 TFU 0.8724
777 I1N 0.8721
778 4XS 0.8721
779 HFB 0.8721
780 SYV 0.8720
781 AUD 0.8720
782 MWP 0.8719
783 4AX 0.8719
784 RUU 0.8718
785 OXC 0.8716
786 FGZ 0.8714
787 4YO 0.8713
788 8WT 0.8712
789 1U6 0.8711
790 FBM 0.8710
791 3OC 0.8709
792 4HC 0.8709
793 1M2 0.8703
794 R1X 0.8702
795 MQN 0.8700
796 DMJ 0.8700
797 F9Y 0.8700
798 948 0.8698
799 3MB 0.8698
800 HZQ 0.8697
801 6M1 0.8697
802 GDE 0.8697
803 TWO 0.8696
804 4XV 0.8695
805 NXA 0.8694
806 RB5 0.8694
807 G3E 0.8693
808 ITN 0.8692
809 7VS 0.8690
810 SKM 0.8690
811 JZ5 0.8689
812 NDM 0.8683
813 KPL 0.8682
814 PQ0 0.8682
815 J5I 0.8681
816 HIO 0.8680
817 DHQ 0.8680
818 IMR 0.8679
819 95Z 0.8677
820 SE2 0.8676
821 IPZ 0.8674
822 FH2 0.8671
823 FLA 0.8671
824 4JQ 0.8670
825 8ZE 0.8670
826 KP6 0.8669
827 SRT 0.8669
828 SIN 0.8667
829 AEF 0.8664
830 2BG 0.8663
831 HLZ 0.8662
832 FDK 0.8662
833 7MU 0.8661
834 DBJ 0.8658
835 5WX 0.8658
836 3PF 0.8657
837 ZXD 0.8657
838 3WA 0.8655
839 IFP 0.8653
840 6RQ 0.8652
841 DAS 0.8652
842 0TU 0.8652
843 EA1 0.8651
844 HCS 0.8650
845 MT0 0.8643
846 TLA 0.8642
847 CFI 0.8639
848 3R6 0.8638
849 RHU 0.8638
850 NVA 0.8637
851 JA8 0.8634
852 3V4 0.8633
853 3SL 0.8632
854 LT2 0.8632
855 FUB 0.8630
856 D48 0.8628
857 JBQ 0.8628
858 UY7 0.8627
859 2MN 0.8627
860 F9P 0.8627
861 AW5 0.8626
862 SS2 0.8626
863 495 0.8625
864 EOL 0.8622
865 PRY 0.8620
866 34D 0.8619
867 X0V 0.8616
868 H7Y 0.8615
869 GLF 0.8613
870 TGX 0.8612
871 2FY 0.8609
872 GLT 0.8607
873 MUA 0.8605
874 XHP 0.8604
875 OTW 0.8604
876 YRL 0.8603
877 DCY 0.8602
878 DBX 0.8600
879 ZWZ 0.8598
880 PNZ 0.8597
881 5RO 0.8594
882 PRF 0.8593
883 TZE 0.8589
884 5RN 0.8589
885 N2I 0.8587
886 ICO 0.8585
887 94B 0.8582
888 MRZ 0.8581
889 OK7 0.8580
890 QX4 0.8571
891 DHS 0.8570
892 KBB 0.8566
893 B60 0.8565
894 7NI 0.8563
895 DHR 0.8561
896 0FO 0.8561
897 SHA 0.8560
898 173 0.8559
899 6KX 0.8555
900 ANN 0.8552
901 DQU 0.8551
902 44W 0.8550
903 JND 0.8545
904 EYK 0.8544
905 HQD 0.8535
906 MVN 0.8533
907 4FH 0.8530
908 CN0 0.8520
909 Q6T 0.8512
910 OW4 0.8507
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 3AVZ; Ligand: ACE SER ALA VAL ALC HSV; 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: 3avz.bio1) has 32 residues
No: Leader PDB Ligand Sequence Similarity
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