Receptor
PDB id Resolution Class Description Source Keywords
6DIH 1.78 Å EC: 3.1.4.- CRYSTAL STRUCTURE OF TDP1 CATALYTIC DOMAIN IN COMPLEX WITH S ALDRICH COMPOUND PH004941 HOMO SAPIENS FRAGMENT-BASED DRUG DESIGN HYDROLASE-HYDROLASE INHIBITOR CO
Ref.: IDENTIFICATION OF A LIGAND BINDING HOT SPOT AND STR MOTIFS REPLICATING ASPECTS OF TYROSYL-DNA PHOSPHODI I (TDP1) PHOSPHORYL RECOGNITION BY CRYSTALLOGRAPHIC COCKTAIL SCREENING. NUCLEIC ACIDS RES. V. 47 10134 2019
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
GJS A:701;
B:701;
 Valid;
Valid;
 none;
none;
 ic50 = 1.9 mM
182.13 C8 H6 O5 c1cc(...
EDO A:703;
B:702;
A:702;
 Invalid;
Invalid;
Invalid;
 none;
none;
none;
 submit data
62.068 C2 H6 O2 C(CO)...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
6DJJ 1.74 Å EC: 3.1.4.- CRYSTAL STRUCTURE OF TDP1 CATALYTIC DOMAIN IN COMPLEX WITH C XZ532 HOMO SAPIENS FRAGMENT-BASED DRUG DESIGN HYDROLASE
Ref.: IDENTIFICATION OF A LIGAND BINDING HOT SPOT AND STR MOTIFS REPLICATING ASPECTS OF TYROSYL-DNA PHOSPHODI I (TDP1) PHOSPHORYL RECOGNITION BY CRYSTALLOGRAPHIC COCKTAIL SCREENING. NUCLEIC ACIDS RES. V. 47 10134 2019
Members (14)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 13 families.
1 6DJH - GNM C10 H6 Br N O3 c1cc2c(c(c....
2 6DJE - GNY C13 H13 N O3 CC(C)c1ccc....
3 6MJ5 - JTA C10 H6 N2 O5 c1cc2c(c(c....
4 6N17 ic50 = 1.01 mM K8Y C12 H11 N O7 c1cc(c(cc1....
5 6DIM - GJP C10 H7 N O3 c1ccc2c(c1....
6 6DJF - GNV C11 H7 N O5 c1cc2c(c(c....
7 6N19 ic50 = 0.96 mM K8V C13 H13 N O7 c1cc(c(cc1....
8 6DIE ic50 = 0.74 mM GHM C9 H6 O6 c1cc(c(cc1....
9 6DJI ic50 = 3.1 mM GOG C8 H6 O5 c1cc(c(c(c....
10 6DHU - GHM C9 H6 O6 c1cc(c(cc1....
11 6DJG - GNJ C10 H7 N O6 S c1cc2c(c(c....
12 6DJD ic50 = 7.2 mM GJP C10 H7 N O3 c1ccc2c(c1....
13 6DJJ ic50 = 80 uM GM7 C8 H7 N O4 c1cc(c(cc1....
14 6DIH ic50 = 1.9 mM GJS C8 H6 O5 c1cc(c(cc1....
70% Homology Family (14)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 12 families.
1 6DJH - GNM C10 H6 Br N O3 c1cc2c(c(c....
2 6DJE - GNY C13 H13 N O3 CC(C)c1ccc....
3 6MJ5 - JTA C10 H6 N2 O5 c1cc2c(c(c....
4 6N17 ic50 = 1.01 mM K8Y C12 H11 N O7 c1cc(c(cc1....
5 6DIM - GJP C10 H7 N O3 c1ccc2c(c1....
6 6DJF - GNV C11 H7 N O5 c1cc2c(c(c....
7 6N19 ic50 = 0.96 mM K8V C13 H13 N O7 c1cc(c(cc1....
8 6DIE ic50 = 0.74 mM GHM C9 H6 O6 c1cc(c(cc1....
9 6DJI ic50 = 3.1 mM GOG C8 H6 O5 c1cc(c(c(c....
10 6DHU - GHM C9 H6 O6 c1cc(c(cc1....
11 6DJG - GNJ C10 H7 N O6 S c1cc2c(c(c....
12 6DJD ic50 = 7.2 mM GJP C10 H7 N O3 c1ccc2c(c1....
13 6DJJ ic50 = 80 uM GM7 C8 H7 N O4 c1cc(c(cc1....
14 6DIH ic50 = 1.9 mM GJS C8 H6 O5 c1cc(c(cc1....
50% Homology Family (14)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 10 families.
1 6DJH - GNM C10 H6 Br N O3 c1cc2c(c(c....
2 6DJE - GNY C13 H13 N O3 CC(C)c1ccc....
3 6MJ5 - JTA C10 H6 N2 O5 c1cc2c(c(c....
4 6N17 ic50 = 1.01 mM K8Y C12 H11 N O7 c1cc(c(cc1....
5 6DIM - GJP C10 H7 N O3 c1ccc2c(c1....
6 6DJF - GNV C11 H7 N O5 c1cc2c(c(c....
7 6N19 ic50 = 0.96 mM K8V C13 H13 N O7 c1cc(c(cc1....
8 6DIE ic50 = 0.74 mM GHM C9 H6 O6 c1cc(c(cc1....
9 6DJI ic50 = 3.1 mM GOG C8 H6 O5 c1cc(c(c(c....
10 6DHU - GHM C9 H6 O6 c1cc(c(cc1....
11 6DJG - GNJ C10 H7 N O6 S c1cc2c(c(c....
12 6DJD ic50 = 7.2 mM GJP C10 H7 N O3 c1ccc2c(c1....
13 6DJJ ic50 = 80 uM GM7 C8 H7 N O4 c1cc(c(cc1....
14 6DIH ic50 = 1.9 mM GJS C8 H6 O5 c1cc(c(cc1....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: GJS; Similar ligands found: 7
No: Ligand ECFP6 Tc MDL keys Tc
1 GJS 1 1
2 GTQ 0.545455 0.863636
3 DOB 0.529412 0.863636
4 GHM 0.444444 0.8
5 GM7 0.432432 0.62963
6 PMA 0.413793 0.8
7 27M 0.405405 0.75
Similar Ligands (3D)
Ligand no: 1; Ligand: GJS; Similar ligands found: 763
No: Ligand Similarity coefficient
1 YQA 0.9830
2 QAT 0.9818
3 QAS 0.9799
4 GZ8 0.9780
5 SXS 0.9742
6 KLW 0.9708
7 LSA 0.9679
8 NTM 0.9677
9 PHT 0.9648
10 EJZ 0.9559
11 APZ 0.9490
12 MWP 0.9478
13 BGC 0.9466
14 20J 0.9451
15 URC 0.9437
16 GCS 0.9436
17 3MG 0.9435
18 G3F 0.9419
19 KT7 0.9415
20 Q71 0.9408
21 0P6 0.9377
22 GLC 0.9375
23 8TX 0.9373
24 8S0 0.9364
25 PXL 0.9344
26 DBX 0.9343
27 A7W 0.9339
28 CWS 0.9337
29 QBK 0.9333
30 GOG 0.9331
31 8CM 0.9320
32 3TJ 0.9311
33 B55 0.9301
34 2ZQ 0.9299
35 DIN 0.9297
36 AJ2 0.9295
37 NCD 0.9294
38 3Z8 0.9293
39 5RG 0.9288
40 KUF 0.9287
41 QX4 0.9285
42 D07 0.9283
43 UEG 0.9283
44 BDP 0.9282
45 UNC 0.9281
46 GAL 0.9278
47 9MG 0.9277
48 MRW 0.9275
49 Q24 0.9268
50 6CS 0.9267
51 AZA 0.9265
52 60Q 0.9262
53 ZZ8 0.9261
54 MUA 0.9259
55 AZ8 0.9257
56 FOT 0.9256
57 FBG 0.9254
58 9TZ 0.9251
59 FA0 0.9245
60 PE0 0.9239
61 AQO 0.9238
62 3IT 0.9234
63 DPZ 0.9233
64 GUN 0.9232
65 ORO 0.9231
66 4M0 0.9231
67 M5K 0.9231
68 39U 0.9230
69 XAZ 0.9229
70 R8V 0.9228
71 5CU 0.9227
72 0W8 0.9227
73 GT0 0.9227
74 G5V 0.9225
75 BTY 0.9224
76 VOH 0.9221
77 AZ9 0.9221
78 9DG 0.9220
79 4HC 0.9220
80 SX1 0.9218
81 1U1 0.9217
82 2D0 0.9216
83 PX7 0.9213
84 4MU 0.9213
85 IGA 0.9213
86 IJZ 0.9212
87 NDM 0.9212
88 BHA 0.9212
89 B5D 0.9211
90 GCU 0.9210
91 J9W 0.9209
92 XHP 0.9208
93 495 0.9208
94 5M0 0.9207
95 54G 0.9207
96 1XN 0.9206
97 HLZ 0.9203
98 75K 0.9200
99 HJP 0.9200
100 0N7 0.9199
101 0FO 0.9198
102 INE 0.9195
103 N5J 0.9195
104 CIT 0.9195
105 UFO 0.9194
106 4ME 0.9193
107 DQU 0.9192
108 1LQ 0.9191
109 XAN 0.9190
110 NID 0.9189
111 Q77 0.9187
112 PXM 0.9185
113 ES0 0.9180
114 M0W 0.9176
115 8IG 0.9176
116 TRA 0.9175
117 24W 0.9174
118 Q7A 0.9173
119 B62 0.9172
120 Q88 0.9172
121 M1Q 0.9170
122 FLC 0.9170
123 4YS 0.9169
124 5NU 0.9168
125 6M4 0.9168
126 AIN 0.9167
127 CFP 0.9165
128 141 0.9163
129 SRO 0.9162
130 7NI 0.9161
131 HQD 0.9158
132 LKA 0.9157
133 7ZE 0.9157
134 1LM 0.9156
135 1SQ 0.9156
136 SHG 0.9154
137 OXC 0.9154
138 ES1 0.9154
139 IPB 0.9153
140 MEW 0.9152
141 JPZ 0.9152
142 JBH 0.9152
143 SWA 0.9151
144 1NP 0.9151
145 CWM 0.9149
146 HQY 0.9148
147 LGC 0.9148
148 MT0 0.9144
149 Q6T 0.9144
150 5Q0 0.9144
151 5JQ 0.9143
152 OTW 0.9143
153 5JL 0.9141
154 5SG 0.9140
155 680 0.9139
156 HXX 0.9138
157 7WR 0.9137
158 6ME 0.9135
159 44W 0.9134
160 GDE 0.9133
161 12B 0.9133
162 M6N 0.9133
163 5IQ 0.9131
164 MVN 0.9131
165 290 0.9125
166 PRF 0.9121
167 DX4 0.9117
168 GCV 0.9115
169 ADZ 0.9115
170 7VS 0.9114
171 C2U 0.9113
172 6R8 0.9112
173 2H5 0.9111
174 M5N 0.9109
175 AKH 0.9108
176 SKM 0.9108
177 DOR 0.9105
178 AZG 0.9104
179 KIB 0.9101
180 O72 0.9096
181 329 0.9094
182 V55 0.9094
183 3M0 0.9094
184 2EC 0.9094
185 A2F 0.9090
186 M1H 0.9089
187 MBG 0.9089
188 8XQ 0.9087
189 GOX 0.9087
190 CFF 0.9086
191 N8Y 0.9085
192 5WY 0.9084
193 4XH 0.9083
194 I6G 0.9082
195 091 0.9082
196 PYQ 0.9081
197 F1A 0.9081
198 DHK 0.9076
199 VNL 0.9076
200 2FQ 0.9076
201 S76 0.9076
202 E7Z 0.9076
203 QPR 0.9073
204 7B4 0.9071
205 LT8 0.9071
206 6AP 0.9070
207 42C 0.9070
208 44V 0.9070
209 EVA 0.9070
210 IV2 0.9069
211 NOJ 0.9068
212 4M4 0.9068
213 RXA 0.9068
214 B57 0.9067
215 NTZ 0.9067
216 BEA 0.9066
217 MO8 0.9066
218 GIM 0.9065
219 HNQ 0.9064
220 5MK 0.9064
221 M3S 0.9064
222 HMU 0.9062
223 DBJ 0.9061
224 HZQ 0.9061
225 D1X 0.9060
226 2AL 0.9060
227 TTL 0.9059
228 HMH 0.9058
229 AEZ 0.9057
230 ENL 0.9055
231 EUG 0.9054
232 6GU 0.9054
233 4NO 0.9053
234 GLA 0.9052
235 7VJ 0.9052
236 TWO 0.9051
237 3WA 0.9051
238 5WX 0.9050
239 DBH 0.9049
240 FYU 0.9049
241 VK3 0.9049
242 KIA 0.9045
243 MAN 0.9042
244 GLY PRO 0.9042
245 NQ 0.9041
246 8WT 0.9040
247 3Z7 0.9039
248 B60 0.9037
249 39A 0.9035
250 K3Q 0.9035
251 MT8 0.9034
252 24B 0.9034
253 ZB1 0.9034
254 DRL 0.9033
255 I3A 0.9033
256 TEP 0.9033
257 7A2 0.9026
258 PFB 0.9025
259 HH8 0.9025
260 2AK 0.9025
261 4TE 0.9024
262 BOA 0.9023
263 AJV 0.9020
264 1P7 0.9019
265 3F0 0.9019
266 JBQ 0.9019
267 GCW 0.9018
268 9KT 0.9018
269 GTR 0.9018
270 149 0.9017
271 YH7 0.9016
272 R9Y 0.9015
273 34D 0.9015
274 F0J 0.9012
275 XQ0 0.9011
276 5NS 0.9011
277 HTP 0.9010
278 37T 0.9010
279 1XM 0.9009
280 ICT 0.9008
281 HH5 0.9007
282 15L 0.9006
283 4Z4 0.9005
284 TOF 0.9003
285 4TU 0.9002
286 86J 0.9001
287 EYK 0.8999
288 MAQ 0.8999
289 2MN 0.8999
290 GCB 0.8995
291 FLV 0.8995
292 D3M 0.8995
293 ADK 0.8994
294 UAN 0.8994
295 6VD 0.8992
296 TRC 0.8992
297 KBB 0.8991
298 BMA 0.8990
299 G2F 0.8990
300 LT2 0.8989
301 3HA 0.8989
302 3MA 0.8989
303 AW5 0.8988
304 PH2 0.8987
305 3C1 0.8987
306 FBT 0.8987
307 12Q 0.8986
308 DNF 0.8985
309 5RO 0.8984
310 JUG 0.8983
311 8GK 0.8981
312 5VJ 0.8980
313 B53 0.8980
314 0CU 0.8980
315 OMD 0.8978
316 32X 0.8977
317 F12 0.8975
318 PRZ 0.8974
319 7W1 0.8974
320 3C2 0.8972
321 ZZT 0.8970
322 NGO 0.8970
323 J01 0.8968
324 2FY 0.8968
325 IPZ 0.8966
326 XXR 0.8965
327 CTS 0.8964
328 5QX 0.8962
329 4V6 0.8961
330 5NE 0.8961
331 QQQ 0.8960
332 KJY 0.8959
333 HQT 0.8959
334 06B 0.8958
335 8W9 0.8958
336 BTE 0.8957
337 EA1 0.8957
338 CLZ 0.8957
339 PQK 0.8956
340 MS9 0.8955
341 BCP 0.8954
342 2A7 0.8952
343 7HQ 0.8951
344 HHR 0.8951
345 H33 0.8951
346 DHQ 0.8950
347 ISN 0.8949
348 BPU 0.8949
349 IFL 0.8949
350 JKZ 0.8947
351 SYV 0.8945
352 QM1 0.8945
353 226 0.8943
354 7ME 0.8938
355 SAL 0.8938
356 GIV 0.8938
357 3ID 0.8938
358 7A3 0.8937
359 F6P 0.8935
360 SKA 0.8934
361 OTD 0.8932
362 MHK 0.8930
363 SVN 0.8930
364 P4B 0.8929
365 1DW 0.8928
366 5RN 0.8925
367 GSY 0.8925
368 209 0.8923
369 SOR 0.8923
370 GIO 0.8921
371 BE2 0.8921
372 G1O 0.8921
373 8VE 0.8919
374 3DM 0.8919
375 7WV 0.8918
376 NOY 0.8917
377 12M 0.8917
378 HPA 0.8916
379 4SV 0.8916
380 G3E 0.8916
381 PFL 0.8914
382 LI6 0.8914
383 M1E 0.8914
384 67X 0.8910
385 KFH 0.8909
386 V6F 0.8908
387 FE DB1 0.8906
388 FDB 0.8905
389 II6 0.8903
390 F31 0.8903
391 YSO 0.8903
392 KKN 0.8902
393 ICO 0.8902
394 03V 0.8901
395 COU 0.8901
396 OA3 0.8901
397 CKX 0.8895
398 Z5P 0.8894
399 4AA 0.8894
400 ES5 0.8894
401 MVL 0.8893
402 8WO 0.8893
403 4HM 0.8893
404 ES6 0.8892
405 OCH 0.8891
406 2FG 0.8891
407 3SK 0.8890
408 ODO 0.8888
409 HA7 0.8887
410 DNC 0.8887
411 JKE 0.8887
412 HHA 0.8887
413 2AQ 0.8886
414 VNJ 0.8884
415 FGZ 0.8883
416 EV0 0.8882
417 HHT 0.8880
418 JND 0.8880
419 PQ0 0.8876
420 2HQ 0.8875
421 ASO 0.8874
422 JTH 0.8874
423 AMG 0.8874
424 1GN 0.8870
425 FDK 0.8870
426 NTC 0.8869
427 DIU 0.8869
428 JB5 0.8869
429 K2P 0.8868
430 4XV 0.8867
431 RM1 0.8864
432 GTZ 0.8863
433 QX2 0.8863
434 7M6 0.8862
435 QWW 0.8862
436 GZL 0.8862
437 F5B 0.8861
438 2A9 0.8859
439 NSP 0.8859
440 ATH 0.8858
441 X8D 0.8858
442 92K 0.8856
443 CN0 0.8856
444 3U4 0.8854
445 CTL 0.8854
446 A13 0.8854
447 PDC 0.8853
448 ZWZ 0.8852
449 ADE 0.8852
450 0FK 0.8852
451 293 0.8850
452 9DA 0.8849
453 39O 0.8849
454 0LH 0.8849
455 GRE 0.8848
456 10L 0.8848
457 TH7 0.8848
458 6MP 0.8847
459 DIE 0.8845
460 GYE 0.8845
461 LDR 0.8843
462 6BL 0.8842
463 ADA 0.8842
464 9HX 0.8841
465 5B1 0.8841
466 EQT 0.8838
467 97T 0.8838
468 JXZ 0.8837
469 3DO 0.8837
470 FH2 0.8835
471 FUL 0.8835
472 NFQ 0.8834
473 TTY 0.8833
474 67N 0.8832
475 LZ2 0.8832
476 BP1 0.8832
477 7W4 0.8831
478 6F0 0.8831
479 7WA 0.8831
480 2KA 0.8831
481 7HP 0.8827
482 X05 0.8826
483 HKD 0.8824
484 DMD 0.8824
485 7B3 0.8824
486 FB1 0.8824
487 M2K 0.8822
488 JBE 0.8822
489 FPK 0.8820
490 4FS 0.8820
491 8H8 0.8819
492 NDH 0.8819
493 GXY 0.8819
494 BK9 0.8818
495 RPQ 0.8818
496 JR2 0.8817
497 4ZC 0.8817
498 23A 0.8817
499 MIG 0.8816
500 PA1 0.8816
501 ZVO 0.8815
502 6LW 0.8813
503 GAF 0.8811
504 ES7 0.8810
505 FRU 0.8810
506 GV9 0.8809
507 9AP 0.8808
508 SWD 0.8807
509 FDR 0.8807
510 6M9 0.8806
511 HLD 0.8804
512 3PF 0.8803
513 SOE 0.8802
514 DNA 0.8802
515 1WD 0.8802
516 C9E 0.8799
517 IP0 0.8799
518 AHR 0.8799
519 4NC 0.8799
520 X6X 0.8798
521 1U6 0.8797
522 M1A 0.8797
523 PHH 0.8797
524 J5I 0.8796
525 4XS 0.8796
526 JXW 0.8796
527 NVU 0.8795
528 SE2 0.8795
529 ZZ3 0.8794
530 82I 0.8793
531 GZQ 0.8791
532 6M1 0.8790
533 ALL 0.8790
534 KBG 0.8788
535 LZM 0.8787
536 PM6 0.8785
537 4JQ 0.8785
538 5QY 0.8784
539 3HB 0.8784
540 F05 0.8783
541 8ZE 0.8782
542 3R6 0.8780
543 WOO 0.8779
544 ES4 0.8778
545 0GZ 0.8778
546 1X7 0.8775
547 SR4 0.8774
548 6XI 0.8774
549 28N 0.8774
550 92P 0.8773
551 2J9 0.8772
552 5WV 0.8772
553 N2I 0.8770
554 3AB 0.8769
555 4AV 0.8767
556 TGX 0.8766
557 JG8 0.8762
558 XX3 0.8760
559 42A 0.8759
560 SHA 0.8754
561 H42 0.8753
562 LCN 0.8749
563 JXN 0.8748
564 JU2 0.8742
565 4JT 0.8741
566 MNM 0.8741
567 A65 0.8741
568 NGT 0.8741
569 9PY 0.8740
570 9R5 0.8737
571 5OB 0.8736
572 2ZV 0.8733
573 AX3 0.8733
574 UQ 0.8733
575 2LY 0.8733
576 3MB 0.8731
577 5PX 0.8730
578 MYJ 0.8729
579 MQN 0.8729
580 9EW 0.8729
581 G12 0.8726
582 069 0.8726
583 XQK 0.8725
584 N8P 0.8724
585 5HN 0.8723
586 YIO 0.8722
587 P3K 0.8721
588 ESI 0.8721
589 5WU 0.8720
590 BHO 0.8719
591 GLT 0.8717
592 18N 0.8716
593 OVM 0.8716
594 1KP 0.8715
595 AH8 0.8714
596 12T 0.8714
597 INO 0.8713
598 8HC 0.8713
599 QUZ 0.8712
600 0F9 0.8711
601 FBB 0.8710
602 0W1 0.8710
603 D48 0.8709
604 FBU 0.8709
605 0FN 0.8708
606 XQG 0.8707
607 NPY 0.8707
608 EMZ 0.8705
609 7D2 0.8705
610 KJU 0.8704
611 ZZZ 0.8702
612 NLQ 0.8701
613 ABV 0.8700
614 TBS 0.8700
615 FBV 0.8700
616 0RW 0.8699
617 ZYR 0.8698
618 95Z 0.8698
619 E35 0.8697
620 P9P 0.8696
621 K32 0.8696
622 X0W 0.8694
623 3NT 0.8694
624 X09 0.8694
625 FHN 0.8692
626 GAB 0.8692
627 NNO 0.8691
628 8NX 0.8691
629 KJH 0.8688
630 DMJ 0.8684
631 PEZ 0.8684
632 WCE 0.8684
633 VXX 0.8683
634 K17 0.8682
635 HLR 0.8682
636 DGJ 0.8682
637 2K8 0.8682
638 C2Y 0.8681
639 IFM 0.8681
640 CBF 0.8676
641 URF 0.8676
642 1WG 0.8674
643 7I2 0.8672
644 948 0.8671
645 0TU 0.8668
646 RMN 0.8666
647 2CK 0.8665
648 MB1 0.8664
649 6RQ 0.8662
650 4YO 0.8662
651 52C 0.8661
652 OVV 0.8661
653 KIF 0.8661
654 AVR 0.8660
655 MIC 0.8659
656 G4D 0.8658
657 270 0.8657
658 AFR 0.8657
659 ET2 0.8655
660 AX7 0.8655
661 FP1 0.8655
662 PZI 0.8650
663 3HM 0.8650
664 H6B 0.8647
665 61O 0.8646
666 QWN 0.8643
667 4VS 0.8642
668 BRT 0.8641
669 H5B 0.8640
670 KGK 0.8639
671 L7T 0.8638
672 TDR 0.8636
673 JZ3 0.8636
674 K22 0.8635
675 173 0.8634
676 43M 0.8634
677 VGD 0.8633
678 GLF 0.8631
679 GTL 0.8629
680 M0Q 0.8629
681 MCO 0.8628
682 KP6 0.8626
683 4ZE 0.8622
684 BZ3 0.8619
685 SF6 0.8619
686 ES2 0.8619
687 8OZ 0.8617
688 34A 0.8614
689 PYD 0.8613
690 150 0.8612
691 TIU 0.8612
692 K2T 0.8610
693 5GU 0.8609
694 MMA 0.8607
695 EOL 0.8606
696 0XT 0.8606
697 TFU 0.8606
698 ICP 0.8605
699 AZF 0.8604
700 TH0 0.8601
701 F81 0.8600
702 MCT 0.8600
703 1F1 0.8598
704 ASC 0.8595
705 2MP 0.8592
706 2CQ 0.8592
707 5NI 0.8590
708 HX3 0.8590
709 QOS 0.8588
710 XX2 0.8586
711 EPR 0.8585
712 2YU 0.8585
713 S3B 0.8584
714 XBZ 0.8584
715 BZJ 0.8584
716 TT4 0.8584
717 1P8 0.8583
718 V1T 0.8583
719 ALA PRO 0.8580
720 OXZ 0.8580
721 C8O 0.8578
722 DX3 0.8575
723 7FF 0.8574
724 7MU 0.8574
725 KYA 0.8573
726 5JC 0.8572
727 MWM 0.8572
728 MT5 0.8571
729 Q02 0.8570
730 HT4 0.8570
731 8G0 0.8568
732 3XX 0.8567
733 QXW 0.8567
734 14O 0.8567
735 XYD 0.8566
736 BCU 0.8564
737 NQM 0.8563
738 MOK 0.8563
739 H7Y 0.8562
740 45C 0.8561
741 APG 0.8560
742 A29 0.8560
743 OW4 0.8555
744 36R 0.8552
745 2AC 0.8551
746 L3Q 0.8549
747 TM7 0.8546
748 9BZ 0.8546
749 F4Z 0.8543
750 KOJ 0.8539
751 TIY 0.8539
752 PHE 0.8538
753 CLW 0.8534
754 3BZ 0.8531
755 6AI 0.8525
756 N7P 0.8525
757 5VM 0.8525
758 JZ2 0.8524
759 MZG 0.8524
760 F60 0.8523
761 45L 0.8520
762 2K4 0.8517
763 SG2 0.8513
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 6DJJ; Ligand: GM7; 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: 6djj.bio2) has 16 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 6DJJ; Ligand: GM7; 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: 6djj.bio1) has 17 residues
No: Leader PDB Ligand Sequence Similarity
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