Receptor
PDB id Resolution Class Description Source Keywords
6M2N 2.2 Å EC: 3.4.22.69 SARS-COV-2 3CL PROTEASE (3CL PRO) IN COMPLEX WITH A NOVEL IN SEVERE ACUTE RESPIRATORY SYNDROME CORO2 SARS-COV-2 3CL PRO VIRAL PROTEIN
Ref.: ANTI-SARS-COV-2 ACTIVITIES IN VITRO OF SHUANGHUANGL PREPARATIONS AND BIOACTIVE INGREDIENTS. ACTA PHARMACOL.SIN. V. 41 1167 2020
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
3WL C:401;
A:401;
D:401;
B:401;
 Valid;
Valid;
Valid;
Valid;
 none;
none;
none;
none;
 Kd = 4.03 uM
270.237 C15 H10 O5 c1ccc...
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: 3WL; Similar ligands found: 5
No: Ligand ECFP6 Tc MDL keys Tc
1 3WL 1 1
2 57D 0.551724 0.903226
3 HUL 0.492308 0.882353
4 0XE 0.461538 0.861111
5 AGI 0.40625 0.903226
Similar Ligands (3D)
Ligand no: 1; Ligand: 3WL; Similar ligands found: 654
No: Ligand Similarity coefficient
1 3JC 0.9815
2 O9T 0.9709
3 O9Z 0.9668
4 NAR 0.9642
5 KMP 0.9639
6 1V3 0.9620
7 1V4 0.9610
8 LU2 0.9589
9 O9Q 0.9568
10 CWE 0.9561
11 QUE 0.9560
12 5NN 0.9525
13 6XC 0.9501
14 VT3 0.9490
15 DFV 0.9489
16 DDC 0.9486
17 NYJ 0.9486
18 W8L 0.9481
19 SAK 0.9480
20 F40 0.9478
21 6QT 0.9474
22 LIG 0.9470
23 MYU 0.9470
24 7LU 0.9465
25 6BK 0.9463
26 7L4 0.9456
27 40N 0.9456
28 CDJ 0.9451
29 3F4 0.9442
30 DQH 0.9441
31 H2W 0.9436
32 3GX 0.9435
33 20D 0.9433
34 6DQ 0.9432
35 RGK 0.9432
36 E9L 0.9429
37 CC6 0.9429
38 SZ5 0.9422
39 DFL 0.9420
40 DH2 0.9419
41 MYC 0.9415
42 25F 0.9410
43 M3W 0.9393
44 AJ4 0.9387
45 338 0.9381
46 6TJ 0.9380
47 BJ4 0.9368
48 PIQ 0.9368
49 A73 0.9366
50 MRI 0.9362
51 1HP 0.9361
52 1Q4 0.9361
53 P4L 0.9360
54 0DF 0.9354
55 E6Q 0.9353
56 D64 0.9353
57 YE7 0.9352
58 1R5 0.9351
59 1V1 0.9346
60 7EH 0.9339
61 SGW 0.9333
62 4L2 0.9328
63 22T 0.9325
64 6B5 0.9324
65 6JM 0.9324
66 NKI 0.9321
67 0H5 0.9320
68 B4L 0.9317
69 1EL 0.9316
70 BUX 0.9307
71 AP6 0.9306
72 AX1 0.9300
73 BHF 0.9293
74 X8E 0.9283
75 5ZM 0.9283
76 HWB 0.9283
77 6JO 0.9282
78 BRY 0.9282
79 DX2 0.9281
80 X8I 0.9275
81 18E 0.9270
82 IMK 0.9269
83 SNJ 0.9269
84 GEN 0.9266
85 IDD 0.9265
86 FSE 0.9264
87 WLH 0.9264
88 IRH 0.9260
89 LI7 0.9256
90 UAY 0.9251
91 5WW 0.9248
92 KXN 0.9245
93 AJ6 0.9244
94 RSV 0.9238
95 J8D 0.9236
96 DX7 0.9235
97 CUE 0.9234
98 6JP 0.9231
99 J8G 0.9230
100 08C 0.9227
101 Q0K 0.9225
102 QS4 0.9221
103 H32 0.9221
104 196 0.9219
105 OUA 0.9215
106 2GQ 0.9210
107 3TI 0.9210
108 OSY 0.9204
109 9CE 0.9200
110 YEX 0.9199
111 NU3 0.9199
112 4CN 0.9199
113 IDZ 0.9198
114 NIF 0.9196
115 FY8 0.9195
116 JTF 0.9194
117 97K 0.9192
118 OA4 0.9192
119 OUG 0.9189
120 27F 0.9188
121 DX8 0.9179
122 2QU 0.9178
123 34L 0.9177
124 MR4 0.9166
125 7M5 0.9165
126 91F 0.9164
127 SU9 0.9164
128 NW1 0.9161
129 2QV 0.9160
130 5B2 0.9156
131 DTQ 0.9153
132 68C 0.9152
133 0OK 0.9151
134 3WJ 0.9149
135 DXK 0.9149
136 LWS 0.9148
137 SDN 0.9145
138 FX5 0.9144
139 LJ5 0.9144
140 1V8 0.9142
141 HH6 0.9141
142 L3L 0.9138
143 7M2 0.9137
144 3WN 0.9124
145 3WO 0.9124
146 A63 0.9122
147 3WK 0.9122
148 XZ1 0.9121
149 FL8 0.9117
150 NRA 0.9116
151 4K2 0.9116
152 UN9 0.9113
153 8M5 0.9110
154 3DE 0.9107
155 52F 0.9107
156 Q11 0.9106
157 KOM 0.9102
158 EMU 0.9091
159 CU8 0.9091
160 OPA 0.9088
161 OTA 0.9085
162 5XM 0.9084
163 0UL 0.9081
164 TH1 0.9079
165 47X 0.9076
166 B2E 0.9075
167 KTM 0.9072
168 KU1 0.9070
169 5P3 0.9066
170 5E1 0.9064
171 4HG 0.9064
172 5E5 0.9063
173 1UZ 0.9063
174 C4E 0.9062
175 AV6 0.9060
176 2OX 0.9060
177 WG8 0.9050
178 RHN 0.9050
179 QUG 0.9048
180 245 0.9046
181 LR2 0.9044
182 AIQ 0.9043
183 COL 0.9039
184 LVY 0.9039
185 5E2 0.9037
186 7VF 0.9032
187 AXX 0.9030
188 272 0.9029
189 8SK 0.9028
190 X0T 0.9026
191 AVX 0.9026
192 35K 0.9023
193 5KN 0.9022
194 CMG 0.9021
195 4YF 0.9020
196 5V7 0.9019
197 MR5 0.9019
198 5WT 0.9015
199 39R 0.9010
200 T5J 0.9009
201 36I 0.9008
202 5VU 0.9004
203 ZRL 0.9003
204 39Z 0.9003
205 79X 0.9001
206 CX6 0.9000
207 Q8G 0.9000
208 2AN 0.8998
209 4KN 0.8994
210 MT6 0.8992
211 5EZ 0.8991
212 E3U 0.8990
213 AUE 0.8988
214 AQN 0.8988
215 7G2 0.8988
216 YZ9 0.8988
217 3QI 0.8987
218 CHQ 0.8986
219 9JT 0.8985
220 6FX 0.8985
221 0MB 0.8983
222 M08 0.8981
223 FZB 0.8981
224 EI1 0.8981
225 BL7 0.8976
226 G2V 0.8976
227 88X 0.8976
228 H0V 0.8973
229 4NR 0.8973
230 Q8D 0.8966
231 FNT 0.8965
232 WST 0.8963
233 LFN 0.8963
234 YJX 0.8958
235 L6Y 0.8957
236 H35 0.8952
237 IQW 0.8950
238 1V0 0.8949
239 ECS 0.8948
240 X2M 0.8947
241 6ZW 0.8944
242 IXM 0.8944
243 TQ1 0.8943
244 BL4 0.8943
245 HFT 0.8942
246 Y70 0.8941
247 E92 0.8941
248 FCW 0.8940
249 KTV 0.8938
250 X2L 0.8938
251 TQ3 0.8938
252 122 0.8937
253 4P9 0.8935
254 NAL 0.8935
255 MHB 0.8933
256 GJW 0.8932
257 BZC 0.8932
258 I0G 0.8931
259 1DR 0.8929
260 ESM 0.8925
261 EQU 0.8925
262 EES 0.8920
263 O53 0.8919
264 801 0.8919
265 69W 0.8919
266 F36 0.8919
267 833 0.8917
268 22M 0.8917
269 609 0.8916
270 CZ0 0.8915
271 IQZ 0.8915
272 B2L 0.8913
273 KLV 0.8913
274 3XL 0.8911
275 CR4 0.8911
276 1UT 0.8911
277 ASE 0.8910
278 FYR 0.8910
279 BMZ 0.8909
280 FHI 0.8908
281 DEH 0.8907
282 EV2 0.8907
283 WDW 0.8906
284 4ZF 0.8906
285 KWB 0.8905
286 121 0.8905
287 HWH 0.8904
288 ZAR 0.8903
289 HRD 0.8901
290 1UR 0.8901
291 YE6 0.8901
292 H75 0.8900
293 Q7U 0.8900
294 Q5M 0.8899
295 ITE 0.8898
296 6DE 0.8898
297 ESR 0.8897
298 TGW 0.8896
299 AUG 0.8896
300 ML1 0.8896
301 A6W 0.8896
302 LC1 0.8895
303 9OF 0.8894
304 II4 0.8892
305 T34 0.8892
306 6H2 0.8892
307 YK9 0.8891
308 3D8 0.8891
309 OAK 0.8890
310 47V 0.8890
311 0SY 0.8890
312 E98 0.8888
313 HKK 0.8888
314 5XL 0.8888
315 B7H 0.8886
316 7FZ 0.8885
317 1FL 0.8884
318 NPZ 0.8879
319 0SX 0.8878
320 ZRK 0.8877
321 A64 0.8876
322 NVS 0.8876
323 P2L 0.8875
324 BIE 0.8875
325 4YE 0.8874
326 EST 0.8874
327 789 0.8874
328 KP2 0.8873
329 RF2 0.8872
330 2JX 0.8872
331 R4E 0.8872
332 M16 0.8872
333 CUH 0.8872
334 108 0.8868
335 7FC 0.8867
336 120 0.8866
337 A05 0.8865
338 TYP 0.8864
339 DL6 0.8863
340 OT4 0.8860
341 4RV 0.8858
342 4AU 0.8856
343 5DN 0.8855
344 SLX 0.8854
345 LUM 0.8853
346 1FE 0.8852
347 9XZ 0.8851
348 2P3 0.8849
349 2WU 0.8846
350 D25 0.8846
351 OAL 0.8843
352 BL6 0.8843
353 LJ1 0.8841
354 LZ7 0.8840
355 S98 0.8838
356 PZB 0.8838
357 K2C 0.8836
358 ZEA 0.8836
359 P9I 0.8834
360 H4B 0.8834
361 NIY 0.8832
362 LJ2 0.8831
363 3G5 0.8830
364 58N 0.8829
365 2UD 0.8829
366 ZTW 0.8828
367 AOB 0.8827
368 Q92 0.8827
369 BIT 0.8827
370 3CA 0.8826
371 L07 0.8825
372 BHM 0.8824
373 UN4 0.8824
374 3AK 0.8820
375 XYP XYP 0.8819
376 CG 0.8818
377 L2K 0.8817
378 UN3 0.8817
379 RVE 0.8814
380 QNM 0.8814
381 EEY 0.8812
382 3RH 0.8812
383 LZJ 0.8811
384 2XY 0.8810
385 J38 0.8810
386 AO 0.8809
387 B61 0.8808
388 CBE 0.8807
389 8HH 0.8807
390 NOM 0.8807
391 4GU 0.8807
392 21E 0.8804
393 J3Z 0.8803
394 124 0.8800
395 BU7 0.8799
396 ISX 0.8799
397 TVC 0.8797
398 4RG 0.8797
399 1AV 0.8796
400 4AJ 0.8794
401 FSU 0.8792
402 ZHA 0.8791
403 HCC 0.8791
404 PE2 0.8790
405 51Y 0.8790
406 205 0.8788
407 MXM 0.8785
408 A9B 0.8785
409 IK1 0.8780
410 697 0.8779
411 6VW 0.8778
412 TCR 0.8778
413 IPJ 0.8777
414 P34 0.8776
415 0DJ 0.8776
416 5DE 0.8774
417 15Q 0.8773
418 HMO 0.8773
419 P4T 0.8772
420 U14 0.8771
421 F18 0.8770
422 BBP 0.8770
423 MBP 0.8769
424 IRG 0.8769
425 Q12 0.8769
426 EF2 0.8768
427 TVZ 0.8767
428 5M2 0.8767
429 MR6 0.8767
430 ZSP 0.8766
431 SNB 0.8766
432 K4T 0.8766
433 AMR 0.8763
434 JF8 0.8762
435 VXP 0.8762
436 7A9 0.8762
437 Q4G 0.8759
438 DN8 0.8757
439 3SU 0.8755
440 64F 0.8752
441 U4J 0.8752
442 PD6 0.8751
443 5XK 0.8751
444 M9K 0.8749
445 2PW 0.8747
446 3UG 0.8747
447 AZN 0.8745
448 BIO 0.8745
449 RDL 0.8744
450 LP8 0.8744
451 EBB 0.8743
452 8E3 0.8742
453 JOH 0.8742
454 5WK 0.8740
455 38E 0.8740
456 658 0.8740
457 17M 0.8739
458 397 0.8739
459 5ER 0.8738
460 K8W 0.8738
461 8WB 0.8738
462 ZIP 0.8738
463 XYS XYP 0.8737
464 8G6 0.8737
465 IY5 0.8736
466 5SD 0.8736
467 OLU 0.8736
468 19E 0.8736
469 D26 0.8734
470 ELH 0.8734
471 ZW2 0.8734
472 ALH 0.8733
473 JVD 0.8733
474 M78 0.8732
475 VUP 0.8732
476 AOM 0.8732
477 AFT 0.8730
478 EVO 0.8729
479 4B8 0.8727
480 ML2 0.8727
481 GNG 0.8727
482 FT6 0.8727
483 0O7 0.8726
484 M9N 0.8726
485 2JK 0.8726
486 SIJ 0.8725
487 XYS XYS 0.8724
488 2ZI 0.8723
489 1XS 0.8722
490 0NJ 0.8721
491 6WL 0.8721
492 M3F 0.8720
493 5CJ 0.8718
494 3C3 0.8718
495 2UV 0.8716
496 BER 0.8713
497 JRO 0.8712
498 MKN 0.8710
499 5P7 0.8709
500 IOP 0.8708
501 0HV 0.8708
502 4YC 0.8706
503 9BF 0.8706
504 OAI 0.8706
505 GWD 0.8705
506 29F 0.8702
507 DZ1 0.8701
508 4AB 0.8700
509 06R 0.8700
510 T21 0.8700
511 ICD 0.8699
512 96Z 0.8698
513 7G0 0.8697
514 1YL 0.8696
515 92O 0.8695
516 ECZ 0.8694
517 3D3 0.8694
518 TXQ 0.8690
519 F4U 0.8690
520 3MI 0.8689
521 HBI 0.8689
522 H2B 0.8689
523 KF5 0.8688
524 6BD 0.8686
525 36K 0.8686
526 PNX 0.8686
527 JWS 0.8686
528 DY9 0.8685
529 1OT 0.8685
530 2D2 0.8684
531 XYP XDN 0.8683
532 PZX 0.8683
533 HRM 0.8682
534 XAV 0.8681
535 XDL XYP 0.8681
536 555 0.8680
537 6WU 0.8679
538 XEV 0.8678
539 TES 0.8678
540 T98 0.8677
541 Z21 0.8674
542 ZJB 0.8670
543 DLZ 0.8669
544 TRP 0.8668
545 GNV 0.8668
546 IIH 0.8665
547 BBY 0.8663
548 62D 0.8663
549 802 0.8661
550 NQ7 0.8660
551 JFS 0.8660
552 U13 0.8660
553 NAB 0.8659
554 G6P 0.8659
555 KN1 0.8658
556 BXZ 0.8656
557 5TU 0.8655
558 B21 0.8653
559 DT7 0.8653
560 WA2 0.8653
561 UQ1 0.8651
562 FHV 0.8649
563 3Q0 0.8648
564 MBT 0.8648
565 KS5 0.8646
566 CUQ 0.8645
567 NWD 0.8644
568 U12 0.8642
569 4Z9 0.8642
570 JO5 0.8640
571 9KQ 0.8636
572 BHS 0.8634
573 5FL 0.8634
574 FER 0.8632
575 AOX 0.8632
576 27M 0.8629
577 QC1 0.8628
578 JKN 0.8627
579 MQR 0.8627
580 SSY 0.8623
581 OAQ 0.8623
582 PRL 0.8622
583 DK1 0.8621
584 5TZ 0.8619
585 5YA 0.8618
586 LL1 0.8618
587 TCW 0.8617
588 ESZ 0.8616
589 5TO 0.8615
590 KW7 0.8612
591 E8Z 0.8612
592 57U 0.8610
593 6EL 0.8609
594 OJ7 0.8608
595 PNJ 0.8607
596 5AD 0.8606
597 1QV 0.8605
598 ADL 0.8605
599 4E2 0.8603
600 4E3 0.8603
601 2GE 0.8603
602 1AJ 0.8603
603 F5C 0.8602
604 J84 0.8601
605 BG8 0.8601
606 MIL 0.8600
607 IQQ 0.8600
608 L1T 0.8600
609 5F8 0.8599
610 GN5 0.8598
611 DHT 0.8598
612 1CE 0.8598
613 L5D 0.8598
614 123 0.8597
615 4FF 0.8595
616 5SB 0.8594
617 9TF 0.8593
618 BSU 0.8593
619 PNW 0.8590
620 BG6 0.8584
621 BGC BGC 0.8583
622 7EL 0.8580
623 F08 0.8579
624 IW6 0.8577
625 TCT 0.8576
626 MG7 0.8575
627 LMZ 0.8572
628 QME 0.8572
629 XEZ 0.8570
630 AJD 0.8568
631 68B 0.8568
632 STL 0.8568
633 4F8 0.8567
634 334 0.8565
635 INR 0.8565
636 NPS 0.8564
637 1TJ 0.8561
638 6X1 0.8557
639 BK2 0.8556
640 EXX 0.8554
641 EAA 0.8553
642 RDV 0.8548
643 6P3 0.8541
644 IW4 0.8540
645 6F3 0.8537
646 CL9 0.8536
647 3Q1 0.8534
648 UXH 0.8531
649 PLP 0.8530
650 PP1 0.8527
651 907 0.8526
652 B23 0.8520
653 1Q1 0.8519
654 22L 0.8506
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
APoc FAQ
Feedback