Receptor
PDB id Resolution Class Description Source Keywords
5C85 1.7 Å NON-ENZYME: OTHER CRYSTAL STRUCTURE OF THE HUMAN BRPF1 BROMODOMAIN IN COMPLEX HOMO SAPIENS BROMODOMAIN AND PHD FINGER-CONTAINING PROTEIN 1(BRPF1) MONOLEUKEMIA ZINC-FINGER (MOZ) INHIBITOR DNA BINDING PROTEIN
Ref.: TWENTY CRYSTAL STRUCTURES OF BROMODOMAIN AND PHD FI CONTAINING PROTEIN 1 (BRPF1)/LIGAND COMPLEXES REVEA CONSERVED BINDING MOTIFS AND RARE INTERACTIONS. J.MED.CHEM. V. 59 5555 2016
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
4YO A:802;
 Valid;
 none;
 Kd = 105 uM
227.058 C8 H7 Br N2 O c1cc2...
NO3 A:801;
 Invalid;
 none;
 submit data
62.005 N O3 [N+](...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
4UYE 1.65 Å NON-ENZYME: OTHER BROMODOMAIN OF HUMAN BRPF1 WITH N-1,3-DIMETHYL-2-OXO-6-( PIPERIDIN-1-YL)-2,3-DIHYDRO-1H-1,3-BENZODIAZOL-5-YL-2- M ETHOXYBENZAMIDE HOMO SAPIENS TRANSCRIPTION INHIBITOR HISTONE EPIGENETIC READER ANTAGO
Ref.: 1,3-DIMETHYL BENZIMIDAZOLONES ARE POTENT, SELECTIVE INHIBITORS OF THE BRPF1 BROMODOMAIN. ACS MED.CHEM.LETT. V. 5 1190 2014
Members (37)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1610 families.
1 5E3G - 5JQ C5 H4 N4 O2 S C12=C(NC(=....
2 5T4U ic50 = 4800 nM 12Q C10 H9 N O CN1c2ccccc....
3 5EWH Kd = 170 uM 5SG C9 H7 N O c1cc2cnccc....
4 5C85 Kd = 105 uM 4YO C8 H7 Br N2 O c1cc2c(cc1....
5 5E3D Kd = 95 uM 5JL C5 H4 N4 O S2 C12=C(NC(=....
6 5C87 - 4YS C9 H7 N O c1ccc2c(c1....
7 5O4T - 9KT C10 H10 N2 O2 CN1c2ccccc....
8 5OV8 Kd = 18 uM AXN C24 H30 N4 O4 S CC(C)Cc1cc....
9 5O4S ic50 = 3.4 uM 9KW C24 H28 N4 O5 S CN1c2cc(c(....
10 5MWH Kd = 1.8 uM UWX C24 H30 N4 O5 S CC(C)Cc1cc....
11 5DY7 - 5GT C9 H7 F3 N2 O c1cc2c(cc1....
12 5T4V ic50 = 60 nM N48 C19 H17 N3 O4 S CC1=CC(=O)....
13 5DYC - 5GU C8 H7 Br N2 O c1cc2c(cc1....
14 5O55 - 9L5 C19 H23 N5 O2 CCN1c2ccc(....
15 5EQ1 Kd = 21 uM BEA C9 H8 N3 S Cc1cccc2c1....
16 5G4S ic50 = 1 uM 8VI C24 H31 N5 O3 CCN(c1cc2c....
17 5EWC - 5SJ C12 H14 N2 O3 CCOC(=O)c1....
18 5EPR Kd = 91 uM 5QY C9 H10 N2 O C[C@H]1C(=....
19 5EVA - 5S9 C11 H9 F2 N3 O Cn1c(ccn1)....
20 5ETD - 5RN C10 H9 N O CC(=O)c1c[....
21 5DYA - 5GV C11 H12 N2 O3 CC[C@@H]1C....
22 5EV9 - 5SB C14 H12 N4 O CC(=O)Nc1c....
23 5MYG Kd = 31 nM LS8 C19 H17 N3 O4 S CC1=Cc2cc(....
24 5MWZ Kd = 7.1 uM KGU C24 H36 N6 O3 CCN1c2cc(c....
25 5G4R ic50 = 7.943 nM LF1 C22 H27 N5 O3 C[C@@H]1CN....
26 5OWA Kd = 3.5 uM B0H C17 H24 N4 O2 S Cc1c(oc(n1....
27 5EM3 - 5Q0 C9 H7 N O c1cc2c(ccc....
28 5ETB Kd = 29 uM 5RO C11 H11 N O Cc1cccc2c1....
29 4UYE Kd = 9.54 nM 9F9 C22 H26 N4 O3 CN1c2cc(c(....
30 5O5F - 9LT C22 H20 F N5 O3 CCN1c2ccc(....
31 5O5A - 9LN C22 H21 N5 O3 CCN1c2ccc(....
32 5O5H - 9LK C17 H14 Cl N3 O3 Cc1c(oc(n1....
33 5C7N Kd = 0.27 uM BMF C17 H20 N6 O4 S CCOC(=O)Nc....
34 5EPS Kd = 38 uM 5QX C9 H10 N2 O CN1c2ccccc....
35 5MWG ic50 = 1.7 uM WGX C25 H30 N4 O4 S CN1c2cc(c(....
36 5D7X Kd = 15 uM XZ8 C14 H13 N3 O2 CC1=C(C(=O....
37 6EKQ Kd = 10.9 uM B0H C17 H24 N4 O2 S Cc1c(oc(n1....
70% Homology Family (39)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1331 families.
1 5E3G - 5JQ C5 H4 N4 O2 S C12=C(NC(=....
2 5T4U ic50 = 4800 nM 12Q C10 H9 N O CN1c2ccccc....
3 5EWH Kd = 170 uM 5SG C9 H7 N O c1cc2cnccc....
4 5C85 Kd = 105 uM 4YO C8 H7 Br N2 O c1cc2c(cc1....
5 5E3D Kd = 95 uM 5JL C5 H4 N4 O S2 C12=C(NC(=....
6 5C87 - 4YS C9 H7 N O c1ccc2c(c1....
7 5O4T - 9KT C10 H10 N2 O2 CN1c2ccccc....
8 5OV8 Kd = 18 uM AXN C24 H30 N4 O4 S CC(C)Cc1cc....
9 5O4S ic50 = 3.4 uM 9KW C24 H28 N4 O5 S CN1c2cc(c(....
10 5MWH Kd = 1.8 uM UWX C24 H30 N4 O5 S CC(C)Cc1cc....
11 5DY7 - 5GT C9 H7 F3 N2 O c1cc2c(cc1....
12 5T4V ic50 = 60 nM N48 C19 H17 N3 O4 S CC1=CC(=O)....
13 5DYC - 5GU C8 H7 Br N2 O c1cc2c(cc1....
14 5O55 - 9L5 C19 H23 N5 O2 CCN1c2ccc(....
15 5EQ1 Kd = 21 uM BEA C9 H8 N3 S Cc1cccc2c1....
16 5G4S ic50 = 1 uM 8VI C24 H31 N5 O3 CCN(c1cc2c....
17 5EWC - 5SJ C12 H14 N2 O3 CCOC(=O)c1....
18 5EPR Kd = 91 uM 5QY C9 H10 N2 O C[C@H]1C(=....
19 5EVA - 5S9 C11 H9 F2 N3 O Cn1c(ccn1)....
20 5ETD - 5RN C10 H9 N O CC(=O)c1c[....
21 5DYA - 5GV C11 H12 N2 O3 CC[C@@H]1C....
22 5EV9 - 5SB C14 H12 N4 O CC(=O)Nc1c....
23 5MYG Kd = 31 nM LS8 C19 H17 N3 O4 S CC1=Cc2cc(....
24 5MWZ Kd = 7.1 uM KGU C24 H36 N6 O3 CCN1c2cc(c....
25 5G4R ic50 = 7.943 nM LF1 C22 H27 N5 O3 C[C@@H]1CN....
26 5OWA Kd = 3.5 uM B0H C17 H24 N4 O2 S Cc1c(oc(n1....
27 5EM3 - 5Q0 C9 H7 N O c1cc2c(ccc....
28 5ETB Kd = 29 uM 5RO C11 H11 N O Cc1cccc2c1....
29 4UYE Kd = 9.54 nM 9F9 C22 H26 N4 O3 CN1c2cc(c(....
30 5O5F - 9LT C22 H20 F N5 O3 CCN1c2ccc(....
31 5O5A - 9LN C22 H21 N5 O3 CCN1c2ccc(....
32 5O5H - 9LK C17 H14 Cl N3 O3 Cc1c(oc(n1....
33 5C7N Kd = 0.27 uM BMF C17 H20 N6 O4 S CCOC(=O)Nc....
34 5EPS Kd = 38 uM 5QX C9 H10 N2 O CN1c2ccccc....
35 5MWG ic50 = 1.7 uM WGX C25 H30 N4 O4 S CN1c2cc(c(....
36 5D7X Kd = 15 uM XZ8 C14 H13 N3 O2 CC1=C(C(=O....
37 6EKQ Kd = 10.9 uM B0H C17 H24 N4 O2 S Cc1c(oc(n1....
38 3RCW - MB3 C5 H9 N O CN1CCCC1=O
39 5N49 ic50 = 450 nM 8LW C22 H17 N3 O3 Cc1cc2c(cc....
50% Homology Family (4)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1144 families.
1 5E3G - 5JQ C5 H4 N4 O2 S C12=C(NC(=....
2 5T4U ic50 = 4800 nM 12Q C10 H9 N O CN1c2ccccc....
3 5EWH Kd = 170 uM 5SG C9 H7 N O c1cc2cnccc....
4 5C85 Kd = 105 uM 4YO C8 H7 Br N2 O c1cc2c(cc1....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: 4YO; Similar ligands found: 3
No: Ligand ECFP6 Tc MDL keys Tc
1 4YO 1 1
2 5GU 0.651163 1
3 1P8 0.408163 0.642857
Similar Ligands (3D)
Ligand no: 1; Ligand: 4YO; Similar ligands found: 1189
No: Ligand Similarity coefficient
1 0TU 1.0000
2 MQN 0.9979
3 4JQ 0.9927
4 9R5 0.9876
5 2HQ 0.9789
6 TGX 0.9760
7 0FO 0.9754
8 15E 0.9735
9 FBB 0.9718
10 K2T 0.9702
11 H42 0.9695
12 QX4 0.9681
13 XHP 0.9678
14 B62 0.9676
15 03V 0.9676
16 COU 0.9675
17 2AQ 0.9674
18 86J 0.9673
19 JB5 0.9671
20 4FS 0.9670
21 DQU 0.9662
22 ES5 0.9660
23 MVN 0.9659
24 OCH 0.9658
25 N2I 0.9643
26 PH2 0.9640
27 3PF 0.9637
28 CLW 0.9635
29 44V 0.9629
30 5QY 0.9629
31 OTW 0.9623
32 36R 0.9622
33 44W 0.9607
34 6ME 0.9607
35 KDV 0.9600
36 VGD 0.9598
37 8ZE 0.9592
38 ES2 0.9582
39 3QV 0.9579
40 D48 0.9579
41 KUF 0.9578
42 G3E 0.9577
43 PRF 0.9577
44 TTL 0.9571
45 BCU 0.9564
46 94W 0.9562
47 5VM 0.9556
48 5WV 0.9555
49 J5I 0.9540
50 2BG 0.9540
51 4JT 0.9535
52 J6W 0.9525
53 HHR 0.9521
54 ET2 0.9521
55 SE2 0.9516
56 CWJ 0.9507
57 E5X 0.9503
58 CTL 0.9501
59 CWS 0.9499
60 PNZ 0.9494
61 0P6 0.9490
62 BGC 0.9490
63 XQ0 0.9486
64 ISN 0.9485
65 XIY 0.9479
66 TYL 0.9476
67 HDH 0.9469
68 5QX 0.9469
69 1M2 0.9461
70 MS9 0.9456
71 7W1 0.9452
72 JAE 0.9447
73 2FY 0.9440
74 KKN 0.9439
75 ES7 0.9438
76 FDR 0.9437
77 3Z8 0.9435
78 ANN 0.9434
79 4NM 0.9432
80 PXL 0.9432
81 UNJ 0.9431
82 AMH 0.9431
83 12Q 0.9430
84 KJU 0.9429
85 ZZZ 0.9429
86 JA8 0.9427
87 MRW 0.9425
88 J9T 0.9422
89 XAZ 0.9419
90 SKA 0.9418
91 BZ3 0.9416
92 2FQ 0.9414
93 7W4 0.9414
94 9FL 0.9412
95 QBK 0.9412
96 3DO 0.9411
97 LT2 0.9411
98 8CM 0.9411
99 BZX 0.9407
100 KJH 0.9405
101 259 0.9404
102 1P7 0.9402
103 AJV 0.9395
104 MSR 0.9395
105 HQT 0.9390
106 N8Y 0.9388
107 4HC 0.9386
108 0JD 0.9385
109 F9Y 0.9383
110 BHA 0.9381
111 ABV 0.9381
112 6RQ 0.9380
113 6NT 0.9380
114 EN1 0.9378
115 HMH 0.9375
116 ODO 0.9374
117 4P5 0.9373
118 R9Y 0.9373
119 QUZ 0.9373
120 I3E 0.9373
121 BEA 0.9372
122 DOB 0.9372
123 5OB 0.9371
124 TH7 0.9370
125 8WO 0.9369
126 Q24 0.9369
127 FA0 0.9369
128 11S 0.9369
129 NPO 0.9368
130 FK1 0.9367
131 SYV 0.9366
132 3ID 0.9366
133 5XC 0.9366
134 DIN 0.9364
135 AZ9 0.9363
136 E7Z 0.9361
137 CLZ 0.9361
138 4M0 0.9361
139 M5K 0.9359
140 A7W 0.9359
141 PHB 0.9359
142 2AK 0.9357
143 I3A 0.9357
144 3ZB 0.9356
145 4BY 0.9356
146 MEW 0.9356
147 J9W 0.9354
148 DMD 0.9354
149 4Z4 0.9354
150 NPY 0.9353
151 CPZ 0.9352
152 NDH 0.9351
153 H4N 0.9350
154 A29 0.9350
155 9CA 0.9350
156 PKU 0.9349
157 2CK 0.9349
158 F4E 0.9349
159 14O 0.9348
160 AJ2 0.9347
161 3BU 0.9346
162 8NY 0.9346
163 BHO 0.9343
164 F60 0.9342
165 PQ0 0.9342
166 5MI 0.9341
167 ISZ 0.9341
168 PAB 0.9339
169 GLC 0.9339
170 2A9 0.9338
171 173 0.9338
172 5H1 0.9336
173 4BZ 0.9336
174 1IT 0.9335
175 PE0 0.9334
176 ES9 0.9331
177 MUA 0.9331
178 7MU 0.9329
179 OTR 0.9322
180 B5D 0.9321
181 CFI 0.9321
182 AQO 0.9318
183 2K4 0.9315
184 AJY 0.9315
185 6AI 0.9315
186 JLZ 0.9314
187 BTY 0.9312
188 5B1 0.9309
189 MR1 0.9306
190 4RU 0.9305
191 5MB 0.9305
192 Z82 0.9305
193 E7S 0.9304
194 AX7 0.9302
195 2K8 0.9302
196 0HO 0.9300
197 AZ8 0.9298
198 RM1 0.9297
199 IWT 0.9296
200 2ZM 0.9295
201 GJP 0.9292
202 4TU 0.9292
203 C1M 0.9291
204 INO 0.9290
205 4AA 0.9290
206 5NI 0.9290
207 M3H 0.9290
208 7HQ 0.9290
209 ZYR 0.9288
210 EA1 0.9287
211 URC 0.9287
212 5JQ 0.9287
213 M1Q 0.9286
214 SNU 0.9286
215 174 0.9285
216 E1T 0.9285
217 5LA 0.9284
218 1KP 0.9283
219 BPN 0.9283
220 4NC 0.9282
221 XX2 0.9282
222 6FZ 0.9281
223 8WT 0.9281
224 IV2 0.9280
225 3HM 0.9278
226 1HN 0.9278
227 3A9 0.9278
228 NIZ 0.9277
229 2MI 0.9277
230 2HU 0.9277
231 0HN 0.9277
232 6NI 0.9277
233 FYU 0.9276
234 HBD 0.9275
235 G3F 0.9273
236 2EC 0.9272
237 HBO 0.9271
238 TZF 0.9271
239 7VP 0.9271
240 X0U 0.9270
241 I1E 0.9270
242 6KT 0.9270
243 FDB 0.9269
244 PBA 0.9267
245 FBM 0.9266
246 FHB 0.9265
247 4A3 0.9264
248 ABI 0.9264
249 3NY 0.9264
250 DHB 0.9262
251 5CU 0.9262
252 NOY 0.9261
253 KTJ 0.9260
254 8W9 0.9259
255 0N7 0.9257
256 MYJ 0.9256
257 HQD 0.9256
258 4BL 0.9256
259 93K 0.9255
260 1F1 0.9255
261 270 0.9254
262 BZ2 0.9254
263 SHA 0.9253
264 8H8 0.9253
265 AN3 0.9252
266 2HO 0.9251
267 PBZ 0.9251
268 XM0 0.9245
269 36Y 0.9244
270 J9Q 0.9244
271 A7H 0.9244
272 LNR 0.9242
273 428 0.9242
274 AC6 0.9242
275 1Y6 0.9242
276 5NU 0.9242
277 4MA 0.9241
278 QWN 0.9241
279 CH9 0.9241
280 15N 0.9240
281 GXY 0.9238
282 NNO 0.9234
283 IFL 0.9234
284 HX4 0.9231
285 6VD 0.9228
286 HHA 0.9227
287 20J 0.9225
288 INE 0.9225
289 ASO 0.9224
290 069 0.9224
291 L22 0.9223
292 4V2 0.9221
293 F9P 0.9221
294 3MB 0.9220
295 4FA 0.9220
296 L99 0.9219
297 J9N 0.9219
298 75K 0.9219
299 826 0.9216
300 SW7 0.9216
301 9TW 0.9216
302 QXW 0.9215
303 5RO 0.9215
304 GAL 0.9215
305 9ZE 0.9214
306 CN0 0.9213
307 TT4 0.9212
308 6M9 0.9211
309 OVM 0.9211
310 4WL 0.9210
311 GCS 0.9210
312 SNO 0.9210
313 IPB 0.9208
314 5RN 0.9207
315 NOJ 0.9205
316 P72 0.9205
317 JDN 0.9203
318 2F6 0.9203
319 PIY 0.9201
320 92K 0.9200
321 4ZA 0.9197
322 ICB 0.9196
323 ESX 0.9196
324 DRL 0.9196
325 ESP 0.9195
326 0BP 0.9195
327 MO8 0.9194
328 0FN 0.9194
329 ASC 0.9193
330 67N 0.9193
331 1A7 0.9193
332 P9P 0.9192
333 JAW 0.9191
334 CHB 0.9191
335 2D0 0.9189
336 Q71 0.9188
337 ICO 0.9188
338 HQJ 0.9188
339 SRT 0.9186
340 3DM 0.9185
341 DBH 0.9185
342 1DW 0.9184
343 TPA 0.9184
344 NSP 0.9183
345 3HA 0.9183
346 GVG 0.9183
347 KT7 0.9182
348 A5E 0.9182
349 PHU 0.9181
350 JG8 0.9181
351 8S0 0.9180
352 3M0 0.9180
353 12T 0.9176
354 HMU 0.9175
355 PIM 0.9175
356 M1A 0.9175
357 HHS 0.9174
358 24W 0.9173
359 LGC 0.9172
360 SN4 0.9171
361 97T 0.9168
362 B55 0.9168
363 8OZ 0.9167
364 3F0 0.9167
365 5JL 0.9165
366 FHC 0.9165
367 CWM 0.9164
368 HIS 0.9163
369 ES0 0.9162
370 8TX 0.9161
371 JB8 0.9160
372 8XL 0.9160
373 L14 0.9158
374 2QC 0.9157
375 P92 0.9157
376 RB5 0.9156
377 1Z6 0.9156
378 1LQ 0.9155
379 XAN 0.9155
380 F05 0.9154
381 R8V 0.9154
382 SOE 0.9151
383 1SQ 0.9149
384 Q88 0.9149
385 JBK 0.9148
386 RNO 0.9147
387 7B4 0.9147
388 HNT 0.9144
389 NAG 0.9143
390 GTQ 0.9143
391 DX3 0.9141
392 G2F 0.9140
393 SLS 0.9140
394 5RG 0.9139
395 ZXD 0.9136
396 OW4 0.9136
397 TSS 0.9136
398 PEY 0.9135
399 1NP 0.9134
400 717 0.9132
401 PYQ 0.9132
402 45L 0.9131
403 PJW 0.9131
404 5SG 0.9131
405 5TY 0.9131
406 0FK 0.9130
407 WOO 0.9130
408 5IQ 0.9129
409 FE DB1 0.9129
410 8HC 0.9129
411 5Q0 0.9129
412 2KA 0.9128
413 ADZ 0.9128
414 4NB 0.9127
415 CK2 0.9125
416 TTY 0.9124
417 LQ2 0.9124
418 4YS 0.9123
419 K34 0.9121
420 A7N 0.9121
421 4I8 0.9119
422 LDP 0.9119
423 M2K 0.9118
424 BDP 0.9118
425 NFM 0.9117
426 42A 0.9117
427 O72 0.9116
428 G12 0.9114
429 ALL 0.9113
430 ES1 0.9112
431 NDG 0.9111
432 27B 0.9110
433 9DG 0.9109
434 68A 0.9109
435 IFP 0.9104
436 39O 0.9104
437 ROI 0.9103
438 1PT 0.9103
439 92P 0.9102
440 MWP 0.9101
441 JPZ 0.9101
442 KBG 0.9099
443 4MU 0.9099
444 0RW 0.9098
445 344 0.9097
446 4CS 0.9097
447 M4T 0.9096
448 BZJ 0.9095
449 BNL 0.9093
450 B60 0.9092
451 3NT 0.9091
452 A2G 0.9090
453 54G 0.9090
454 N5J 0.9090
455 VK3 0.9089
456 9EW 0.9089
457 GDL 0.9088
458 HQY 0.9088
459 YRL 0.9088
460 JYB 0.9088
461 AZA 0.9086
462 0W8 0.9086
463 NQ 0.9084
464 6M4 0.9084
465 GF4 0.9083
466 HHH 0.9083
467 W81 0.9082
468 BPU 0.9081
469 NID 0.9081
470 MAQ 0.9081
471 4XR 0.9081
472 KOJ 0.9080
473 IHB 0.9078
474 APZ 0.9077
475 B57 0.9077
476 XDE 0.9076
477 3AB 0.9076
478 ALE 0.9076
479 OAA 0.9075
480 GZL 0.9075
481 X05 0.9074
482 M0W 0.9074
483 X0V 0.9074
484 4JC 0.9073
485 7ME 0.9072
486 DBJ 0.9069
487 C2Y 0.9069
488 32X 0.9068
489 KW8 0.9067
490 CTS 0.9067
491 GAB 0.9067
492 8IG 0.9066
493 BK9 0.9066
494 GWM 0.9065
495 2LY 0.9065
496 L5V 0.9065
497 KJY 0.9065
498 LZM 0.9065
499 GUN 0.9065
500 5HN 0.9064
501 SAL 0.9064
502 24B 0.9062
503 M4S 0.9061
504 TYR 0.9060
505 5M0 0.9059
506 PH3 0.9059
507 VXX 0.9059
508 AAS 0.9057
509 OVP 0.9057
510 N0Z 0.9057
511 SVN 0.9057
512 3U4 0.9056
513 1WG 0.9055
514 RXA 0.9052
515 268 0.9050
516 AA 0.9049
517 UFO 0.9048
518 HLR 0.9046
519 141 0.9046
520 FQI 0.9045
521 HLZ 0.9045
522 HSO 0.9044
523 3HB 0.9043
524 RD4 0.9043
525 FCR 0.9043
526 9RW 0.9042
527 BE2 0.9042
528 NCT 0.9041
529 DE5 0.9040
530 3R4 0.9040
531 SWA 0.9038
532 Q77 0.9038
533 6AP 0.9038
534 8NB 0.9036
535 6GU 0.9036
536 ESI 0.9035
537 8NX 0.9034
538 IGA 0.9034
539 86L 0.9033
540 7VS 0.9033
541 PZI 0.9032
542 TSU 0.9030
543 795 0.9030
544 JBH 0.9029
545 R20 0.9028
546 RMN 0.9027
547 6FB 0.9027
548 0NX 0.9026
549 TOF 0.9026
550 OQC 0.9026
551 GNM 0.9026
552 NGA 0.9024
553 SOR 0.9022
554 HX3 0.9022
555 OVV 0.9022
556 4FH 0.9021
557 R8S 0.9020
558 ES6 0.9018
559 PZM 0.9017
560 B53 0.9017
561 DIE 0.9016
562 YH7 0.9016
563 KTW 0.9016
564 37T 0.9016
565 6QF 0.9015
566 M45 0.9015
567 TWO 0.9014
568 492 0.9014
569 ANF 0.9014
570 CFP 0.9013
571 MPV 0.9012
572 HH5 0.9012
573 DHQ 0.9012
574 WCE 0.9009
575 1LM 0.9009
576 4XH 0.9006
577 5VL 0.9005
578 HA5 0.9004
579 3R6 0.9001
580 OW7 0.9001
581 0XT 0.9001
582 A2F 0.9000
583 FUD 0.9000
584 GCU 0.9000
585 9MG 0.8999
586 BOA 0.8999
587 H4E 0.8996
588 ZZT 0.8996
589 QSB 0.8995
590 TH0 0.8995
591 F4K 0.8994
592 3WA 0.8994
593 GO2 0.8994
594 HBA 0.8993
595 FBS 0.8992
596 SMN 0.8991
597 290 0.8991
598 DHR 0.8991
599 4SV 0.8990
600 3BZ 0.8989
601 XYP 0.8989
602 QMP 0.8987
603 BPY 0.8987
604 GDE 0.8987
605 AHR 0.8987
606 SKM 0.8987
607 GVY 0.8986
608 2CQ 0.8986
609 HC4 0.8985
610 8GC 0.8985
611 4ME 0.8985
612 JXN 0.8984
613 BRT 0.8984
614 M1H 0.8983
615 EKZ 0.8981
616 VOH 0.8980
617 D3G 0.8980
618 QBM 0.8980
619 ADA 0.8979
620 X0W 0.8979
621 SQ7 0.8979
622 HH8 0.8978
623 TAG 0.8978
624 PAC 0.8978
625 9TZ 0.8978
626 SX1 0.8976
627 NIO 0.8976
628 MLT 0.8975
629 7MX 0.8975
630 BCP 0.8972
631 1XM 0.8972
632 M0Q 0.8970
633 AC0 0.8970
634 54Z 0.8967
635 Z5P 0.8967
636 BEN 0.8967
637 PHE 0.8967
638 52C 0.8966
639 GCB 0.8966
640 DGJ 0.8965
641 SAN 0.8965
642 BAM 0.8965
643 THA 0.8963
644 5MK 0.8962
645 PQK 0.8962
646 NCA 0.8961
647 14J 0.8961
648 BBK 0.8960
649 AZG 0.8960
650 2AL 0.8960
651 F31 0.8960
652 GLO 0.8959
653 53C 0.8958
654 FP1 0.8957
655 PA1 0.8957
656 1WC 0.8957
657 EVA 0.8956
658 DX4 0.8955
659 4SX 0.8955
660 KBZ 0.8955
661 7B3 0.8954
662 QSH 0.8954
663 6PC 0.8954
664 9KT 0.8954
665 QIV 0.8953
666 JBE 0.8953
667 36E 0.8953
668 FAN 0.8953
669 BEZ 0.8952
670 SJ5 0.8951
671 DEN 0.8951
672 AKG 0.8951
673 0CU 0.8950
674 0F9 0.8949
675 92G 0.8948
676 UNU 0.8948
677 GOJ 0.8948
678 PPY 0.8947
679 YCP 0.8947
680 C9E 0.8946
681 K4V 0.8945
682 SRO 0.8945
683 OK7 0.8944
684 H5B 0.8943
685 4VP 0.8943
686 GJZ 0.8943
687 6TZ 0.8943
688 F2W 0.8942
689 LXC 0.8942
690 CXH 0.8941
691 JU2 0.8941
692 LMR 0.8940
693 JF1 0.8940
694 AL0 0.8939
695 G6D 0.8939
696 CFF 0.8938
697 DEE 0.8938
698 NBZ 0.8938
699 9FE 0.8935
700 4J8 0.8935
701 ANC 0.8933
702 VNL 0.8933
703 7N0 0.8931
704 DBX 0.8930
705 6CS 0.8930
706 3OC 0.8929
707 PZA 0.8928
708 82I 0.8927
709 N4E 0.8927
710 2HC 0.8927
711 5NE 0.8925
712 DRG 0.8923
713 M1E 0.8923
714 PBC 0.8920
715 APG 0.8920
716 LI6 0.8919
717 IDM 0.8919
718 APS 0.8919
719 Y3L 0.8917
720 D07 0.8917
721 X09 0.8916
722 UAN 0.8916
723 G4D 0.8916
724 OA3 0.8916
725 Q02 0.8916
726 23J 0.8916
727 3IT 0.8916
728 2GS 0.8915
729 3FH 0.8915
730 HRM 0.8914
731 YZM 0.8913
732 HNK 0.8913
733 RAT 0.8911
734 ONR 0.8911
735 30G 0.8911
736 HHI 0.8910
737 ARP 0.8910
738 NMJ 0.8909
739 JBQ 0.8908
740 AEF 0.8908
741 H8N 0.8907
742 H7Y 0.8905
743 QSC 0.8905
744 IND 0.8905
745 AMS 0.8904
746 PO6 0.8903
747 PD2 0.8903
748 KMY 0.8903
749 Q6T 0.8902
750 PXM 0.8900
751 TC7 0.8900
752 N91 0.8898
753 GYE 0.8897
754 150 0.8896
755 MAJ 0.8893
756 B56 0.8891
757 IAC 0.8891
758 DNA 0.8890
759 3VX 0.8889
760 QUS 0.8889
761 S2G 0.8888
762 JF2 0.8888
763 JXW 0.8887
764 PDC 0.8887
765 SXS 0.8886
766 80G 0.8886
767 K5W 0.8886
768 JKE 0.8885
769 K82 0.8884
770 GZ2 0.8881
771 1L5 0.8880
772 25W 0.8880
773 EUE 0.8879
774 7NI 0.8878
775 S0E 0.8878
776 DYA 0.8878
777 GTR 0.8876
778 EUG 0.8876
779 4M4 0.8876
780 0LH 0.8876
781 BZI 0.8876
782 GRE 0.8875
783 42C 0.8875
784 209 0.8874
785 F4Z 0.8873
786 MCT 0.8872
787 HPS 0.8871
788 BNF 0.8870
789 2H5 0.8870
790 DHK 0.8870
791 SS1 0.8870
792 PHH 0.8869
793 UEG 0.8868
794 F1A 0.8867
795 H62 0.8866
796 XBT 0.8866
797 4LW 0.8865
798 VNJ 0.8865
799 FGZ 0.8865
800 36M 0.8863
801 SKF 0.8862
802 TIY 0.8862
803 EYK 0.8860
804 FK8 0.8860
805 EQT 0.8860
806 5WY 0.8859
807 6M1 0.8858
808 4HM 0.8858
809 IF7 0.8857
810 51R 0.8857
811 E35 0.8855
812 0W1 0.8853
813 MAN 0.8853
814 V1T 0.8852
815 BZF 0.8852
816 PEA 0.8852
817 4XV 0.8850
818 C2B 0.8850
819 LZ1 0.8850
820 3W8 0.8849
821 FBF 0.8849
822 AES 0.8849
823 JZ9 0.8848
824 GLA 0.8848
825 4JP 0.8847
826 V55 0.8844
827 5GV 0.8844
828 MNM 0.8844
829 ZEC 0.8843
830 DNF 0.8843
831 61M 0.8842
832 0R1 0.8842
833 NTN 0.8842
834 SYA 0.8841
835 8MO 0.8839
836 HHT 0.8838
837 URF 0.8837
838 XQG 0.8836
839 5MH 0.8836
840 42J 0.8835
841 7ZE 0.8835
842 1WD 0.8834
843 RHU 0.8834
844 ZBT 0.8834
845 DPZ 0.8832
846 C53 0.8832
847 3J8 0.8831
848 SME 0.8831
849 1U6 0.8831
850 1MC 0.8830
851 5XB 0.8829
852 MPI 0.8829
853 XBZ 0.8828
854 FBA 0.8827
855 4JM 0.8827
856 PYD 0.8827
857 23A 0.8826
858 PRZ 0.8824
859 4HO 0.8824
860 HA7 0.8824
861 4VY 0.8823
862 JND 0.8823
863 7MK 0.8822
864 UNC 0.8820
865 JZ3 0.8820
866 X6X 0.8819
867 45C 0.8818
868 H33 0.8817
869 0CT 0.8817
870 149 0.8816
871 GGL 0.8816
872 M58 0.8816
873 PFB 0.8816
874 43M 0.8816
875 1AL 0.8815
876 DIU 0.8815
877 DHC 0.8814
878 GAF 0.8813
879 NDM 0.8813
880 1P3 0.8810
881 LKA 0.8810
882 VGL 0.8810
883 JVN 0.8809
884 GVH 0.8809
885 FA1 0.8808
886 M6N 0.8806
887 RA7 0.8806
888 2ZQ 0.8804
889 F0J 0.8804
890 549 0.8803
891 28N 0.8803
892 TEP 0.8803
893 XRG 0.8803
894 293 0.8802
895 KYA 0.8802
896 4JL 0.8801
897 6E8 0.8800
898 FBV 0.8799
899 BSP 0.8797
900 OGA 0.8797
901 SHG 0.8796
902 GXL 0.8794
903 2BX 0.8794
904 FDK 0.8794
905 B85 0.8794
906 FBW 0.8793
907 MWM 0.8793
908 MT0 0.8792
909 E3D 0.8791
910 2LP 0.8791
911 CXP 0.8791
912 4ZE 0.8791
913 7WV 0.8790
914 4KL 0.8790
915 1GN 0.8789
916 JFJ 0.8788
917 AKH 0.8786
918 K32 0.8785
919 IUR 0.8785
920 TIU 0.8784
921 MD6 0.8784
922 JBZ 0.8780
923 N1E 0.8779
924 EVF 0.8779
925 6F0 0.8779
926 HPA 0.8778
927 XYD 0.8778
928 QY9 0.8777
929 TDR 0.8777
930 EXO 0.8777
931 2AC 0.8776
932 M4E 0.8775
933 4JO 0.8774
934 GO8 0.8773
935 HKD 0.8773
936 R2P 0.8772
937 MZG 0.8772
938 N7I 0.8771
939 495 0.8770
940 XCZ 0.8770
941 UFV 0.8769
942 SWD 0.8768
943 ADE 0.8767
944 Q7A 0.8765
945 HZQ 0.8765
946 2FG 0.8764
947 E1K 0.8763
948 363 0.8763
949 4XS 0.8762
950 7O4 0.8761
951 275 0.8761
952 IT2 0.8760
953 MWJ 0.8759
954 FQX 0.8758
955 39A 0.8758
956 EXD 0.8756
957 1XA 0.8756
958 5JC 0.8756
959 HJP 0.8755
960 YIO 0.8754
961 ZVO 0.8754
962 K22 0.8751
963 E3X 0.8751
964 HCI 0.8750
965 4HP 0.8749
966 261 0.8749
967 PCA 0.8748
968 A65 0.8748
969 S7J 0.8748
970 ENO 0.8747
971 S60 0.8746
972 M78 0.8746
973 BTE 0.8745
974 EV3 0.8744
975 GCO 0.8744
976 27Y 0.8744
977 ZZA 0.8743
978 F5B 0.8742
979 4CL 0.8742
980 4JJ 0.8742
981 GIV 0.8741
982 091 0.8741
983 5UC 0.8740
984 XXR 0.8739
985 5NS 0.8737
986 3XX 0.8737
987 SEP 0.8736
988 B1J 0.8736
989 IJZ 0.8735
990 C2U 0.8734
991 NDD 0.8734
992 FOT 0.8732
993 EMZ 0.8731
994 NF3 0.8731
995 3AE 0.8731
996 WBU 0.8731
997 RSO 0.8730
998 1XN 0.8730
999 RUY 0.8726
1000 7VJ 0.8726
1001 34A 0.8725
1002 JTH 0.8723
1003 R9S 0.8723
1004 ORO 0.8722
1005 JZ2 0.8721
1006 IDH 0.8720
1007 9PY 0.8719
1008 QWW 0.8719
1009 3SL 0.8718
1010 A1U 0.8718
1011 1SA 0.8717
1012 DPT 0.8717
1013 XXP 0.8717
1014 2ZV 0.8717
1015 95Z 0.8716
1016 BGU 0.8716
1017 2YU 0.8716
1018 CXF 0.8714
1019 0R0 0.8714
1020 K37 0.8714
1021 BR9 0.8714
1022 2O6 0.8713
1023 2MP 0.8713
1024 TLD 0.8713
1025 9NB 0.8712
1026 QPR 0.8712
1027 NHG 0.8712
1028 QX2 0.8711
1029 X48 0.8711
1030 K17 0.8710
1031 3RK 0.8709
1032 KIB 0.8708
1033 D2G 0.8706
1034 3VS 0.8706
1035 RAM 0.8704
1036 5WX 0.8702
1037 P9E 0.8700
1038 LR5 0.8700
1039 TBS 0.8698
1040 1DV 0.8697
1041 OXC 0.8696
1042 6MP 0.8696
1043 AY4 0.8695
1044 10L 0.8695
1045 0FR 0.8693
1046 ICP 0.8692
1047 GLN 0.8692
1048 329 0.8692
1049 PFL 0.8691
1050 ODK 0.8690
1051 4ZC 0.8689
1052 O2A 0.8687
1053 BMA 0.8686
1054 JXK 0.8685
1055 CIT 0.8685
1056 G1O 0.8683
1057 P3K 0.8681
1058 8K2 0.8680
1059 2HG 0.8680
1060 4NZ 0.8679
1061 HT4 0.8679
1062 ITE 0.8678
1063 PX7 0.8675
1064 7WG 0.8672
1065 OKG 0.8672
1066 Z13 0.8671
1067 LDR 0.8671
1068 FBT 0.8669
1069 FB1 0.8669
1070 GIF 0.8668
1071 M5H 0.8668
1072 TMG 0.8668
1073 TM7 0.8668
1074 3VQ 0.8667
1075 JUG 0.8666
1076 TXW 0.8665
1077 PMB 0.8664
1078 K3Q 0.8664
1079 GJS 0.8662
1080 680 0.8662
1081 BP1 0.8662
1082 K6X 0.8661
1083 BIK 0.8659
1084 AW5 0.8659
1085 KGK 0.8657
1086 SJK 0.8657
1087 LSA 0.8657
1088 3QM 0.8656
1089 X8D 0.8656
1090 WSD 0.8655
1091 GZ8 0.8654
1092 9AP 0.8653
1093 ISE 0.8650
1094 GGB 0.8649
1095 RSF 0.8648
1096 3SK 0.8648
1097 BVA 0.8646
1098 7MW 0.8645
1099 FUL 0.8644
1100 LO1 0.8643
1101 JP2 0.8642
1102 CSN 0.8642
1103 12B 0.8641
1104 7HP 0.8641
1105 QBS 0.8640
1106 9DA 0.8640
1107 4HB 0.8640
1108 VC3 0.8639
1109 ES4 0.8639
1110 NVU 0.8638
1111 A09 0.8637
1112 XCG 0.8636
1113 SR1 0.8632
1114 BHQ 0.8631
1115 BP7 0.8628
1116 K44 0.8628
1117 QAT 0.8628
1118 9HX 0.8628
1119 DHY 0.8628
1120 7WA 0.8627
1121 LZ2 0.8627
1122 IOS 0.8626
1123 4CM 0.8625
1124 AX3 0.8623
1125 FB2 0.8623
1126 DA4 0.8620
1127 226 0.8619
1128 Y8I 0.8618
1129 QOS 0.8617
1130 0TR 0.8617
1131 BZE 0.8617
1132 QIC 0.8616
1133 BNT 0.8615
1134 OMD 0.8614
1135 FPY 0.8613
1136 NGO 0.8612
1137 FLV 0.8612
1138 N2M 0.8612
1139 1VK 0.8610
1140 PRL 0.8610
1141 4VS 0.8609
1142 WS7 0.8608
1143 DOR 0.8607
1144 I2E 0.8604
1145 152 0.8603
1146 54X 0.8603
1147 RIP 0.8602
1148 INS 0.8600
1149 DHS 0.8598
1150 P80 0.8594
1151 FA3 0.8593
1152 PRA 0.8592
1153 2MH 0.8591
1154 GLU 0.8590
1155 QAS 0.8589
1156 S7S 0.8585
1157 56D 0.8585
1158 ZYX 0.8585
1159 DFU 0.8583
1160 I6G 0.8581
1161 PEP 0.8579
1162 4NP 0.8579
1163 K8X 0.8578
1164 KJ5 0.8577
1165 IQ5 0.8577
1166 PM6 0.8576
1167 0MK 0.8574
1168 FUC 0.8574
1169 D1X 0.8573
1170 2FX 0.8572
1171 449 0.8571
1172 6X9 0.8570
1173 DFB 0.8568
1174 CIY 0.8566
1175 JFD 0.8563
1176 A13 0.8563
1177 F12 0.8561
1178 4MB 0.8548
1179 AMC 0.8547
1180 M6Z 0.8547
1181 ASP 0.8545
1182 L7T 0.8543
1183 AZM 0.8538
1184 7WR 0.8536
1185 XIZ 0.8536
1186 537 0.8527
1187 6BL 0.8527
1188 JIF 0.8522
1189 6L6 0.8516
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 4UYE; Ligand: 9F9; Similar sites found with APoc: 4
This union binding pocket(no: 1) in the query (biounit: 4uye.bio1) has 19 residues
No: Leader PDB Ligand Sequence Similarity
1 4YC9 4C1 35.5932
2 6J3O B4L 38.1356
3 5MLJ 9ST 40.1786
4 5ML0 P2L 45.4545
Pocket No.: 2; Query (leader) PDB : 4UYE; Ligand: 9F9; Similar sites found with APoc: 7
This union binding pocket(no: 2) in the query (biounit: 4uye.bio2) has 16 residues
No: Leader PDB Ligand Sequence Similarity
1 6J3P B8O 38.1356
2 6J3O B4L 38.1356
3 6J3P B8O 38.1356
4 5TPX 7H7 38.9831
5 5MLJ 9ST 40.1786
6 5MLJ 9ST 40.1786
7 5ML0 P2L 45.4545
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