Receptor
PDB id Resolution Class Description Source Keywords
5TNP 1.85 Å NON-ENZYME: OTHER CRYSTAL STRUCTURE OF THE E153Q MUTANT OF THE CFTR INHIBITORY CIF CONTAINING THE ADDUCTED STYRENE OXIDE HYDROLYSIS INTERM PSEUDOMONAS AERUGINOSA (STRAIN UCBPP-PORGANISM_TAXID: 208963 EPOXIDE HYDROLASE HYDROXYALKYL-ENZYME INTERMEDIATE HYDROLA
Ref.: ACTIVE-SITE FLEXIBILITY AND SUBSTRATE SPECIFICITY I BACTERIAL VIRULENCE FACTOR: CRYSTALLOGRAPHIC SNAPSH EPOXIDE HYDROLASE. STRUCTURE V. 25 697 2017
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
FEH C:401;
A:401;
B:402;
C:402;
A:402;
B:401;
D:401;
D:402;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
Atoms found LESS than expected: % Diff = 0.1;
Atoms found LESS than expected: % Diff = 0.1;
Atoms found LESS than expected: % Diff = 0.1;
Atoms found LESS than expected: % Diff = 0.1;
Atoms found LESS than expected: % Diff = 0.1;
Atoms found LESS than expected: % Diff = 0.1;
Atoms found LESS than expected: % Diff = 0.1;
Atoms found LESS than expected: % Diff = 0.1;
submit data
138.164 C8 H10 O2 c1ccc...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
5HK9 1.8 Å NON-ENZYME: OTHER CRYSTAL STRUCTURE OF THE CFTR INHIBITORY FACTOR CIF BOUND TO INHIBITOR PSEUDOMONAS AERUGINOSA (STRAIN UCBPP-PORGANISM_TAXID: 208963 BACTERIAL EPOXIDE HYDROLASE INHIBITOR HYDROLASE-HYDROLASE COMPLEX
Ref.: RATIONAL DESIGN OF POTENT AND SELECTIVE INHIBITORS EPOXIDE HYDROLASE VIRULENCE FACTOR FROM PSEUDOMONAS AERUGINOSA. J.MED.CHEM. V. 59 4790 2016
Members (6)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1610 families.
1 5TNP - FEH C8 H10 O2 c1ccc(cc1)....
2 5HK9 ic50 = 0.29 uM 64O C22 H19 Cl2 N3 O4 CCC(=O)Nc1....
3 5HKA ic50 = 0.35 uM 64N C22 H18 Cl2 N2 O4 CCC(=O)Nc1....
4 4YX9 Ki = 4.5 uM 4HY C14 H9 I3 O4 c1cc(c(cc1....
5 5HKB ic50 = 2.6 uM 64L C18 H17 Br2 N O5 CC(C)c1cc(....
6 5TNS - 7EX C6 H10 O C1CC[C@H]2....
70% Homology Family (6)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1331 families.
1 5TNP - FEH C8 H10 O2 c1ccc(cc1)....
2 5HK9 ic50 = 0.29 uM 64O C22 H19 Cl2 N3 O4 CCC(=O)Nc1....
3 5HKA ic50 = 0.35 uM 64N C22 H18 Cl2 N2 O4 CCC(=O)Nc1....
4 4YX9 Ki = 4.5 uM 4HY C14 H9 I3 O4 c1cc(c(cc1....
5 5HKB ic50 = 2.6 uM 64L C18 H17 Br2 N O5 CC(C)c1cc(....
6 5TNS - 7EX C6 H10 O C1CC[C@H]2....
50% Homology Family (6)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1144 families.
1 5TNP - FEH C8 H10 O2 c1ccc(cc1)....
2 5HK9 ic50 = 0.29 uM 64O C22 H19 Cl2 N3 O4 CCC(=O)Nc1....
3 5HKA ic50 = 0.35 uM 64N C22 H18 Cl2 N2 O4 CCC(=O)Nc1....
4 4YX9 Ki = 4.5 uM 4HY C14 H9 I3 O4 c1cc(c(cc1....
5 5HKB ic50 = 2.6 uM 64L C18 H17 Br2 N O5 CC(C)c1cc(....
6 5TNS - 7EX C6 H10 O C1CC[C@H]2....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: FEH; Similar ligands found: 1
No: Ligand ECFP6 Tc MDL keys Tc
1 FEH 1 1
Similar Ligands (3D)
Ligand no: 1; Ligand: FEH; Similar ligands found: 855
No: Ligand Similarity coefficient
1 F9P 1.0000
2 BHO 1.0000
3 NIZ 1.0000
4 ISZ 1.0000
5 CFI 1.0000
6 MXN 0.9969
7 I1E 0.9953
8 1DJ 0.9857
9 FBM 0.9839
10 54D 0.9834
11 BEZ 0.9823
12 NCA 0.9801
13 BEN 0.9800
14 MNN 0.9797
15 HY1 0.9781
16 TZL 0.9776
17 ZBT 0.9776
18 BAM 0.9772
19 UNU 0.9770
20 NBZ 0.9769
21 PMB 0.9768
22 SYG 0.9763
23 NIO 0.9756
24 PZA 0.9754
25 6PC 0.9754
26 PBC 0.9751
27 TPA 0.9737
28 M6W 0.9732
29 FBJ 0.9732
30 M58 0.9722
31 FAN 0.9707
32 GJZ 0.9702
33 J9T 0.9698
34 GRO 0.9693
35 BNS 0.9681
36 XBT 0.9675
37 QSC 0.9670
38 RMN 0.9665
39 SHA 0.9662
40 PHU 0.9657
41 FB2 0.9625
42 SS2 0.9624
43 CXF 0.9622
44 NYL 0.9621
45 PEL 0.9620
46 SMN 0.9618
47 271 0.9615
48 SS1 0.9614
49 YCP 0.9608
50 NTN 0.9608
51 45L 0.9606
52 PEA 0.9605
53 6M4 0.9605
54 069 0.9602
55 HDH 0.9600
56 OTR 0.9597
57 CEE 0.9596
58 A09 0.9594
59 XIY 0.9576
60 QY9 0.9575
61 T9G 0.9573
62 VGL 0.9570
63 8OZ 0.9567
64 269 0.9562
65 JZ7 0.9561
66 RSO 0.9556
67 PAB 0.9554
68 SAL 0.9554
69 BNF 0.9554
70 OAA 0.9549
71 PHB 0.9543
72 AEF 0.9540
73 NPO 0.9528
74 PAC 0.9520
75 268 0.9519
76 2PC 0.9517
77 258 0.9511
78 JBN 0.9511
79 IT2 0.9510
80 1M2 0.9507
81 717 0.9507
82 173 0.9500
83 PZI 0.9498
84 OK7 0.9494
85 N4B 0.9492
86 COI 0.9483
87 RBJ 0.9474
88 JZ5 0.9467
89 PBZ 0.9465
90 GAB 0.9463
91 YRL 0.9462
92 AC6 0.9460
93 TH7 0.9460
94 TP5 0.9455
95 2BG 0.9455
96 264 0.9455
97 9RW 0.9445
98 FBV 0.9445
99 4FA 0.9444
100 DE5 0.9439
101 P72 0.9437
102 K34 0.9433
103 3OC 0.9431
104 263 0.9431
105 4JT 0.9431
106 PRO 0.9428
107 RB5 0.9426
108 XYL 0.9426
109 FOA 0.9425
110 1DQ 0.9423
111 HMH 0.9420
112 PKU 0.9418
113 MRZ 0.9415
114 3HB 0.9413
115 AC0 0.9413
116 7MU 0.9413
117 GOJ 0.9412
118 HBA 0.9411
119 RM1 0.9410
120 AL0 0.9408
121 HSM 0.9403
122 49F 0.9402
123 IDM 0.9402
124 LT1 0.9401
125 2LP 0.9398
126 SMV 0.9396
127 SYN 0.9395
128 L99 0.9395
129 BE2 0.9394
130 BSX 0.9392
131 53C 0.9390
132 IP0 0.9388
133 ES6 0.9388
134 3NT 0.9386
135 DHR 0.9385
136 FB1 0.9383
137 C21 0.9382
138 HL5 0.9379
139 PRA 0.9378
140 3U4 0.9377
141 TSU 0.9377
142 HBD 0.9376
143 GAG 0.9369
144 JFJ 0.9368
145 FA0 0.9368
146 1P8 0.9359
147 1Y6 0.9359
148 FBW 0.9359
149 I4B 0.9359
150 VNJ 0.9358
151 NMJ 0.9358
152 RBL 0.9357
153 1DU 0.9356
154 MLT 0.9356
155 GTQ 0.9355
156 LDP 0.9355
157 SAN 0.9354
158 K7M 0.9353
159 PRY 0.9351
160 JKE 0.9351
161 RJY 0.9350
162 LNR 0.9350
163 JZ4 0.9350
164 EDR 0.9348
165 ABN 0.9347
166 PEP 0.9346
167 5RG 0.9345
168 XM0 0.9343
169 NCT 0.9341
170 GZL 0.9340
171 PCA 0.9339
172 40E 0.9337
173 FQI 0.9337
174 9CL 0.9336
175 XUL 0.9336
176 HSO 0.9335
177 7N0 0.9334
178 TFB 0.9333
179 FCR 0.9333
180 LMR 0.9332
181 APG 0.9324
182 DHB 0.9319
183 282 0.9319
184 QDK 0.9318
185 273 0.9316
186 3SK 0.9315
187 PYJ 0.9314
188 XCZ 0.9312
189 5AC 0.9312
190 1LN 0.9310
191 HIS 0.9309
192 AAS 0.9309
193 3M0 0.9308
194 5M0 0.9307
195 A29 0.9306
196 4HP 0.9306
197 UY7 0.9302
198 261 0.9301
199 60P 0.9301
200 4NC 0.9301
201 1SA 0.9301
202 DBH 0.9298
203 FK8 0.9296
204 PRS 0.9294
205 TZE 0.9294
206 PIM 0.9293
207 3AB 0.9293
208 P9P 0.9293
209 K5W 0.9292
210 B09 0.9291
211 EKZ 0.9290
212 PBA 0.9289
213 54G 0.9288
214 KOJ 0.9287
215 MS9 0.9284
216 4VY 0.9283
217 4CS 0.9282
218 FBS 0.9282
219 1DV 0.9278
220 1WD 0.9276
221 HBX 0.9272
222 DOB 0.9272
223 51F 0.9272
224 92K 0.9272
225 5CU 0.9270
226 SW7 0.9270
227 APY 0.9268
228 4VP 0.9266
229 TYL 0.9266
230 RNS 0.9263
231 2AL 0.9262
232 SRT 0.9256
233 23J 0.9255
234 RHU 0.9255
235 ICO 0.9255
236 FP1 0.9254
237 8ZE 0.9253
238 CXP 0.9248
239 3QM 0.9248
240 KTA 0.9247
241 3F0 0.9247
242 AKG 0.9247
243 ROR 0.9246
244 OXQ 0.9245
245 GBD 0.9244
246 51R 0.9242
247 SIN 0.9242
248 2PG 0.9242
249 8WT 0.9240
250 S8V 0.9240
251 DPR 0.9240
252 9TZ 0.9239
253 PO6 0.9236
254 4SV 0.9234
255 8GC 0.9233
256 3HA 0.9232
257 SD4 0.9231
258 BNL 0.9230
259 AHR 0.9227
260 OGA 0.9225
261 4J8 0.9225
262 JF6 0.9225
263 4M0 0.9224
264 5QY 0.9222
265 SAF 0.9222
266 ASP 0.9220
267 XX2 0.9219
268 NBE 0.9217
269 ASN 0.9215
270 ASC 0.9215
271 GVG 0.9214
272 JAB 0.9213
273 AMC 0.9213
274 61M 0.9212
275 ABV 0.9211
276 FUM 0.9211
277 BCU 0.9211
278 Q88 0.9207
279 HIO 0.9206
280 2FY 0.9206
281 0OC 0.9205
282 HQJ 0.9204
283 MPV 0.9203
284 7WG 0.9203
285 B24 0.9203
286 LYL 0.9200
287 7A8 0.9199
288 AEG 0.9198
289 7C3 0.9198
290 IZC 0.9196
291 LEU 0.9196
292 URS 0.9194
293 JZ3 0.9194
294 B40 0.9193
295 M4T 0.9193
296 ORN 0.9191
297 GLU 0.9188
298 MR1 0.9188
299 HY3 0.9188
300 M3H 0.9187
301 HCI 0.9184
302 BE7 0.9184
303 4JL 0.9181
304 HHH 0.9181
305 XIZ 0.9180
306 2EC 0.9180
307 PNZ 0.9178
308 BHA 0.9176
309 ORO 0.9173
310 ALA ALA 0.9172
311 3SL 0.9172
312 KIV 0.9172
313 I38 0.9170
314 DEE 0.9169
315 7WV 0.9165
316 L5V 0.9164
317 FBA 0.9164
318 0LH 0.9163
319 AX7 0.9161
320 PMF 0.9160
321 TEO 0.9159
322 TLA 0.9158
323 X0V 0.9156
324 6FZ 0.9155
325 HHA 0.9155
326 FOC 0.9154
327 DTL 0.9152
328 M45 0.9152
329 HX3 0.9149
330 XLS 0.9148
331 NXA 0.9148
332 J0Z 0.9147
333 GLY ALA 0.9145
334 5FX 0.9144
335 UYA 0.9144
336 F4E 0.9143
337 PBN 0.9142
338 XDE 0.9142
339 ALE 0.9142
340 EHM 0.9141
341 2RH 0.9138
342 CRN 0.9137
343 ZZT 0.9135
344 SYC 0.9135
345 PY7 0.9133
346 42J 0.9133
347 GLN 0.9132
348 MSR 0.9131
349 IFP 0.9131
350 FPI 0.9131
351 FA1 0.9125
352 5MK 0.9125
353 HMU 0.9123
354 HYA 0.9122
355 MET 0.9121
356 0R0 0.9121
357 1P3 0.9119
358 P92 0.9118
359 URF 0.9118
360 3H2 0.9116
361 YPN 0.9116
362 C2B 0.9115
363 24B 0.9114
364 1MR 0.9114
365 GYE 0.9113
366 IHG 0.9112
367 PIY 0.9111
368 DEN 0.9109
369 NSP 0.9109
370 T2C 0.9109
371 3HP 0.9107
372 CPZ 0.9105
373 NLE 0.9102
374 3C4 0.9099
375 PHE 0.9098
376 JYD 0.9098
377 Q9Z 0.9096
378 2CO 0.9096
379 GGL 0.9095
380 52C 0.9094
381 GUA 0.9094
382 3DO 0.9093
383 FE DB1 0.9090
384 SPA 0.9089
385 EV0 0.9087
386 AS3 0.9086
387 DMV 0.9086
388 N2Z 0.9086
389 DS0 0.9085
390 DGL 0.9083
391 IND 0.9083
392 DGN 0.9082
393 3LR 0.9081
394 QMP 0.9081
395 7VP 0.9081
396 HYP 0.9080
397 HL4 0.9080
398 2HG 0.9077
399 K6H 0.9077
400 SSB 0.9076
401 SNE 0.9073
402 KDF 0.9073
403 ILE 0.9072
404 R2P 0.9072
405 OHP 0.9071
406 ICB 0.9070
407 PPY 0.9069
408 R20 0.9069
409 R67 0.9068
410 TAG 0.9068
411 NDH 0.9067
412 BZI 0.9067
413 HPS 0.9066
414 NK 0.9065
415 6CS 0.9063
416 HZP 0.9063
417 SYM 0.9061
418 DOR 0.9061
419 YZM 0.9060
420 HX4 0.9058
421 0JD 0.9058
422 ODO 0.9058
423 3FH 0.9057
424 BGC 0.9057
425 IPB 0.9056
426 MUC 0.9055
427 MAE 0.9053
428 J6W 0.9052
429 DAL DAL 0.9052
430 MED 0.9052
431 DHY 0.9051
432 KMT 0.9049
433 98J 0.9047
434 TT4 0.9047
435 DAS 0.9046
436 BPW 0.9045
437 RNT 0.9042
438 AFR 0.9041
439 2FT 0.9040
440 4JP 0.9040
441 BZF 0.9036
442 TSS 0.9035
443 4FH 0.9033
444 TTL 0.9032
445 URQ 0.9031
446 THE 0.9031
447 A13 0.9031
448 GRE 0.9029
449 1L5 0.9028
450 LCN 0.9027
451 VKC 0.9027
452 3YP 0.9026
453 1A7 0.9025
454 BP9 0.9023
455 4AA 0.9023
456 6M1 0.9022
457 270 0.9021
458 9J3 0.9020
459 4SX 0.9020
460 PH3 0.9020
461 DBX 0.9019
462 IFM 0.9019
463 B85 0.9019
464 DHS 0.9018
465 A5E 0.9018
466 R9M 0.9016
467 C2U 0.9016
468 8S0 0.9013
469 LZ1 0.9012
470 PYF 0.9012
471 P7Y 0.9012
472 C2A 0.9011
473 K6V 0.9010
474 SVD 0.9009
475 HC4 0.9008
476 ASO 0.9008
477 PEQ 0.9007
478 2MI 0.9007
479 HDA 0.9007
480 GBN 0.9007
481 PGA 0.9006
482 GLC 0.9003
483 4HM 0.9002
484 Q03 0.9001
485 CCB 0.9001
486 NOJ 0.8999
487 6F0 0.8998
488 23W 0.8997
489 OHG 0.8996
490 UGC 0.8994
491 R8A 0.8992
492 SJ5 0.8991
493 FBT 0.8991
494 ITN 0.8990
495 IQ0 0.8990
496 DHK 0.8990
497 S2G 0.8988
498 E35 0.8988
499 O7U 0.8986
500 4JM 0.8985
501 AOT 0.8985
502 0V5 0.8984
503 GP9 0.8983
504 PAF 0.8983
505 MEV 0.8983
506 NFM 0.8983
507 TAR 0.8982
508 SPV 0.8982
509 DYA 0.8981
510 ACA 0.8980
511 9R5 0.8978
512 DIU 0.8976
513 LYS 0.8975
514 HCS 0.8975
515 Q02 0.8974
516 15N 0.8974
517 D1X 0.8973
518 HHI 0.8973
519 3IT 0.8971
520 HX2 0.8970
521 R9S 0.8966
522 MPI 0.8966
523 EYK 0.8965
524 B2J 0.8965
525 SOE 0.8964
526 CIZ 0.8964
527 GLL 0.8963
528 KYD 0.8963
529 GIF 0.8963
530 URO 0.8963
531 2IT 0.8962
532 OKG 0.8961
533 9RH 0.8961
534 GVH 0.8958
535 8K2 0.8958
536 286 0.8958
537 3BU 0.8958
538 LER 0.8957
539 MRY 0.8956
540 KPL 0.8955
541 TYE 0.8955
542 CMS 0.8951
543 2AS 0.8951
544 NK1 0.8947
545 3XX 0.8946
546 P80 0.8945
547 2D8 0.8944
548 2HC 0.8944
549 SR1 0.8943
550 PTU 0.8942
551 4XR 0.8941
552 0R1 0.8941
553 JRB 0.8940
554 6TZ 0.8939
555 KBG 0.8938
556 46P 0.8938
557 FUD 0.8937
558 HSE 0.8937
559 JB8 0.8936
560 ZXD 0.8934
561 AHB 0.8931
562 HPP 0.8931
563 AHC 0.8930
564 ONL 0.8929
565 13P 0.8929
566 9X7 0.8927
567 CSS 0.8927
568 JLZ 0.8926
569 HVQ 0.8926
570 6NA 0.8926
571 GLY GLY 0.8924
572 HFA 0.8924
573 791 0.8924
574 JDN 0.8923
575 Q6T 0.8922
576 34D 0.8921
577 1WC 0.8920
578 GZQ 0.8919
579 G4D 0.8918
580 MLE 0.8917
581 PPT 0.8917
582 MZ0 0.8916
583 BVC 0.8916
584 BHH 0.8915
585 SC2 0.8914
586 SKM 0.8913
587 G2F 0.8911
588 CWM 0.8911
589 OMD 0.8910
590 IOM 0.8907
591 FA3 0.8907
592 KBB 0.8907
593 DHI 0.8905
594 DAV 0.8905
595 FRU 0.8904
596 69O 0.8904
597 DGJ 0.8904
598 MTL 0.8903
599 SHI 0.8902
600 92P 0.8900
601 9YL 0.8899
602 EUG 0.8899
603 RIB 0.8898
604 EDG 0.8898
605 42C 0.8897
606 TCA 0.8897
607 HNL 0.8897
608 GZ3 0.8896
609 PBE 0.8896
610 SHO 0.8896
611 JZ1 0.8895
612 PG3 0.8894
613 P58 0.8893
614 SDD 0.8892
615 VXX 0.8892
616 4PN 0.8890
617 1CO 0.8889
618 MEQ 0.8888
619 IFL 0.8888
620 DFB 0.8887
621 FOT 0.8886
622 DQA 0.8885
623 QUS 0.8884
624 PSJ 0.8881
625 PJW 0.8880
626 RAT 0.8879
627 PZM 0.8879
628 3AL 0.8879
629 BPN 0.8879
630 ES0 0.8878
631 MES 0.8878
632 1GP 0.8877
633 G3H 0.8876
634 G3P 0.8876
635 SOR 0.8876
636 I3E 0.8874
637 S2P 0.8873
638 IXW 0.8873
639 AX3 0.8872
640 2CL 0.8871
641 X1S 0.8871
642 H8N 0.8870
643 DCL 0.8870
644 BDF 0.8868
645 1AB 0.8867
646 4Z4 0.8864
647 MSE 0.8863
648 LNO 0.8863
649 MJ2 0.8862
650 5XB 0.8862
651 ZGL 0.8862
652 R2B 0.8861
653 KP6 0.8857
654 GAL 0.8857
655 9SE 0.8857
656 PGH 0.8855
657 AMS 0.8855
658 GLY CYS 0.8855
659 GLO 0.8851
660 449 0.8849
661 4MV 0.8849
662 MLA 0.8849
663 DYT 0.8847
664 AOS 0.8847
665 BDP 0.8846
666 CYX 0.8846
667 TIH 0.8846
668 LPK 0.8843
669 M5E 0.8841
670 AC5 0.8840
671 293 0.8840
672 ZZ3 0.8840
673 34V 0.8839
674 C2Y 0.8838
675 0VT 0.8835
676 AZF 0.8835
677 LDU 0.8834
678 LRH 0.8834
679 SOL 0.8832
680 GLY PRO 0.8832
681 IJZ 0.8832
682 KMH 0.8830
683 CP 0.8828
684 N9J 0.8828
685 AKH 0.8827
686 MLI 0.8826
687 LTL 0.8825
688 4RW 0.8824
689 HA5 0.8823
690 IPZ 0.8822
691 56D 0.8821
692 HF2 0.8820
693 PAE 0.8819
694 36M 0.8818
695 4XV 0.8818
696 OXZ 0.8815
697 PPR 0.8814
698 2BX 0.8814
699 SME 0.8812
700 41K 0.8811
701 H7Y 0.8811
702 IF7 0.8809
703 2F6 0.8806
704 AHN 0.8804
705 GCO 0.8804
706 HXX 0.8802
707 M74 0.8801
708 2XX 0.8798
709 2EZ 0.8798
710 H95 0.8798
711 NOY 0.8797
712 3HL 0.8797
713 LYN 0.8794
714 NMG 0.8793
715 GWM 0.8793
716 8EW 0.8791
717 LFC 0.8790
718 5DI 0.8788
719 AAE 0.8788
720 B3U 0.8787
721 LVD 0.8787
722 URP 0.8786
723 S24 0.8786
724 7MX 0.8782
725 AGK 0.8781
726 LLQ 0.8779
727 ZZ2 0.8777
728 EOL 0.8776
729 ICF 0.8775
730 82I 0.8774
731 WOT 0.8770
732 CH9 0.8770
733 MNM 0.8769
734 2A9 0.8769
735 CN0 0.8769
736 ISD 0.8769
737 CFA 0.8768
738 SX1 0.8767
739 FBU 0.8767
740 2LY 0.8766
741 DMJ 0.8765
742 XSP 0.8764
743 PSE 0.8762
744 OEG 0.8760
745 4P0 0.8760
746 4ME 0.8759
747 PJL 0.8757
748 EGR 0.8753
749 S0H 0.8752
750 SEP 0.8749
751 AEH 0.8748
752 AMH 0.8743
753 S76 0.8743
754 FSG 0.8743
755 2DR 0.8743
756 PRZ 0.8741
757 DPN 0.8741
758 TL6 0.8741
759 EOU 0.8741
760 NFA 0.8738
761 HQ9 0.8734
762 BVG 0.8734
763 DHC 0.8733
764 6LW 0.8733
765 SN4 0.8731
766 2H5 0.8730
767 G2H 0.8729
768 N6C 0.8728
769 KDG 0.8728
770 ARW 0.8727
771 JND 0.8726
772 QIC 0.8726
773 F81 0.8723
774 A3M 0.8723
775 HGA 0.8723
776 CUW 0.8723
777 SHF 0.8723
778 3OL 0.8723
779 Q07 0.8722
780 VAL 0.8721
781 8U3 0.8719
782 M6H 0.8719
783 6ZX 0.8718
784 HNK 0.8718
785 4M4 0.8717
786 3PG 0.8717
787 3V4 0.8713
788 RUU 0.8713
789 2FG 0.8713
790 DIG 0.8705
791 278 0.8703
792 4XS 0.8703
793 ACH 0.8697
794 G5V 0.8696
795 PAH 0.8696
796 AG2 0.8695
797 CIT 0.8693
798 F06 0.8693
799 FF3 0.8690
800 UN1 0.8690
801 7Q1 0.8689
802 3HG 0.8680
803 EVA 0.8679
804 6OT 0.8679
805 23A 0.8679
806 SF9 0.8676
807 MAN 0.8674
808 HJP 0.8671
809 ADA 0.8671
810 GLA 0.8670
811 GAF 0.8669
812 PLU 0.8666
813 1BN 0.8665
814 L13 0.8665
815 DTU 0.8661
816 GCB 0.8653
817 TNE 0.8653
818 CS2 0.8644
819 0QW 0.8643
820 KJM 0.8641
821 2C2 0.8640
822 129 0.8637
823 GG6 0.8627
824 P2D 0.8627
825 3MF 0.8625
826 FUB 0.8622
827 149 0.8619
828 2A7 0.8619
829 ALO 0.8616
830 X6X 0.8614
831 OSE 0.8610
832 DTT 0.8607
833 280 0.8605
834 R1X 0.8604
835 PG0 0.8600
836 AAN 0.8600
837 YIO 0.8592
838 PRI 0.8592
839 TSR 0.8588
840 GXL 0.8586
841 BRH 0.8584
842 1GN 0.8578
843 D3G 0.8578
844 AKB 0.8571
845 NEQ 0.8569
846 H76 0.8563
847 QBS 0.8562
848 P3K 0.8561
849 260 0.8560
850 9KH 0.8558
851 9TY 0.8548
852 505 0.8544
853 3PP 0.8544
854 8GL 0.8541
855 SKG 0.8516
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 5HK9; Ligand: 64O; 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: 5hk9.bio1) has 24 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 5HK9; Ligand: 64O; 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: 5hk9.bio1) has 22 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 3; Query (leader) PDB : 5HK9; Ligand: 64O; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 3) in the query (biounit: 5hk9.bio2) has 21 residues
No: Leader PDB Ligand Sequence Similarity
APoc FAQ
Feedback