Receptor
PDB id Resolution Class Description Source Keywords
4DNJ 1.8 Å EC: 1.14.-.- THE CRYSTAL STRUCTURES OF 4-METHOXYBENZOATE BOUND CYP199A2 RHODOPSEUDOMONAS PALUSTRIS OXIDOREDUCTASE
Ref.: THE CRYSTAL STRUCTURES OF 4-METHOXYBENZOATE BOUND C AND CYP199A4: STRUCTURAL CHANGES ON SUBSTRATE BINDI THE IDENTIFICATION OF AN ANION BINDING SITE DALTON TRANS V. 41 8703 2012
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
ANN A:502;
 Valid;
 none;
 submit data
152.147 C8 H8 O3 COc1c...
CL A:503;
 Invalid;
 none;
 submit data
35.453 Cl [Cl-]
HEM A:501;
 Part of Protein;
 none;
 submit data
616.487 C34 H32 Fe N4 O4 Cc1c2...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
4DNJ 1.8 Å EC: 1.14.-.- THE CRYSTAL STRUCTURES OF 4-METHOXYBENZOATE BOUND CYP199A2 RHODOPSEUDOMONAS PALUSTRIS OXIDOREDUCTASE
Ref.: THE CRYSTAL STRUCTURES OF 4-METHOXYBENZOATE BOUND C AND CYP199A4: STRUCTURAL CHANGES ON SUBSTRATE BINDI THE IDENTIFICATION OF AN ANION BINDING SITE DALTON TRANS V. 41 8703 2012
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 20 families.
1 4DNJ - ANN C8 H8 O3 COc1ccc(cc....
70% Homology Family (12)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1331 families.
1 6PQW Kd = 89 uM OVV C8 H8 O2 Cc1cccc(c1....
2 4DO1 Kd = 0.28 uM ANN C8 H8 O3 COc1ccc(cc....
3 6U30 Kd = 2.3 uM PQM C12 H9 N O2 c1cc(cnc1)....
4 6PQD Kd = 33 uM OVP C8 H8 O2 S CSc1cccc(c....
5 6PQ6 Kd = 69 uM OVM C8 H8 O3 COc1cccc(c....
6 6U3K Kd = 1 uM PQS C12 H9 N O2 c1ccnc(c1)....
7 6PQS Kd = 0.66 uM 4MA C8 H8 O2 Cc1ccc(cc1....
8 6PRR Kd = 31 uM OW4 C8 H9 N O2 CNc1cccc(c....
9 4EGN Kd = 29.5 uM TWO C9 H10 O4 COc1ccc(cc....
10 4EGO Kd = 44.4 uM 1F1 C9 H7 N O2 c1cc(cc2c1....
11 6PRS Kd = 82 uM OW7 C9 H10 O3 CCOc1cccc(....
12 4DNJ - ANN C8 H8 O3 COc1ccc(cc....
50% Homology Family (12)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1144 families.
1 6PQW Kd = 89 uM OVV C8 H8 O2 Cc1cccc(c1....
2 4DO1 Kd = 0.28 uM ANN C8 H8 O3 COc1ccc(cc....
3 6U30 Kd = 2.3 uM PQM C12 H9 N O2 c1cc(cnc1)....
4 6PQD Kd = 33 uM OVP C8 H8 O2 S CSc1cccc(c....
5 6PQ6 Kd = 69 uM OVM C8 H8 O3 COc1cccc(c....
6 6U3K Kd = 1 uM PQS C12 H9 N O2 c1ccnc(c1)....
7 6PQS Kd = 0.66 uM 4MA C8 H8 O2 Cc1ccc(cc1....
8 6PRR Kd = 31 uM OW4 C8 H9 N O2 CNc1cccc(c....
9 4EGN Kd = 29.5 uM TWO C9 H10 O4 COc1ccc(cc....
10 4EGO Kd = 44.4 uM 1F1 C9 H7 N O2 c1cc(cc2c1....
11 6PRS Kd = 82 uM OW7 C9 H10 O3 CCOc1cccc(....
12 4DNJ - ANN C8 H8 O3 COc1ccc(cc....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: ANN; Similar ligands found: 7
No: Ligand ECFP6 Tc MDL keys Tc
1 ANN 1 1
2 5O6 0.513514 0.818182
3 4MA 0.483871 0.611111
4 PHB 0.451613 0.789474
5 OVM 0.447368 1
6 U4J 0.431818 0.857143
7 TWO 0.421053 0.75
Similar Ligands (3D)
Ligand no: 1; Ligand: ANN; Similar ligands found: 1082
No: Ligand Similarity coefficient
1 PNZ 1.0000
2 BPN 1.0000
3 SN4 0.9992
4 4NM 0.9980
5 AMH 0.9974
6 E5X 0.9972
7 259 0.9917
8 SNO 0.9852
9 4BZ 0.9803
10 SW7 0.9797
11 HBD 0.9786
12 PAB 0.9785
13 PBZ 0.9770
14 NPO 0.9766
15 Z82 0.9754
16 174 0.9746
17 RNO 0.9741
18 P72 0.9737
19 I3E 0.9732
20 8WO 0.9730
21 4NB 0.9717
22 1Y6 0.9710
23 LQ2 0.9706
24 826 0.9694
25 6NT 0.9689
26 AC6 0.9681
27 1F1 0.9659
28 0HN 0.9651
29 6KT 0.9649
30 M4S 0.9649
31 0HO 0.9645
32 L14 0.9640
33 A7N 0.9630
34 2ZM 0.9628
35 6NI 0.9622
36 4WL 0.9619
37 BCU 0.9612
38 1M2 0.9611
39 4P5 0.9610
40 8ZE 0.9605
41 JAW 0.9604
42 5LA 0.9601
43 4JC 0.9601
44 2HU 0.9591
45 5NI 0.9587
46 TYL 0.9587
47 JDN 0.9578
48 4ZA 0.9577
49 XIY 0.9573
50 F9Y 0.9572
51 2BG 0.9571
52 KDV 0.9569
53 BZ2 0.9568
54 MSR 0.9565
55 5XC 0.9563
56 3A9 0.9558
57 3NY 0.9558
58 FA0 0.9548
59 JLZ 0.9540
60 HDH 0.9539
61 BZ3 0.9538
62 4VP 0.9522
63 HC4 0.9522
64 TZF 0.9521
65 PZM 0.9510
66 BHA 0.9509
67 ESP 0.9503
68 4FA 0.9503
69 N2I 0.9502
70 JB8 0.9496
71 AES 0.9493
72 4M0 0.9492
73 DOB 0.9490
74 DHR 0.9488
75 ABI 0.9488
76 5OB 0.9484
77 SNU 0.9482
78 ICB 0.9479
79 FCR 0.9478
80 HBA 0.9477
81 4AA 0.9476
82 F4E 0.9476
83 H42 0.9476
84 TSU 0.9475
85 4J8 0.9471
86 94W 0.9469
87 12T 0.9468
88 TGX 0.9468
89 ES2 0.9467
90 MR1 0.9467
91 DHB 0.9465
92 CPZ 0.9462
93 INO 0.9462
94 FBF 0.9461
95 OTR 0.9460
96 F4K 0.9460
97 KBZ 0.9456
98 ESX 0.9455
99 K2T 0.9454
100 CLW 0.9454
101 2HO 0.9454
102 4BY 0.9453
103 C1M 0.9451
104 5CU 0.9445
105 1P8 0.9444
106 2A9 0.9441
107 XYL 0.9441
108 RB5 0.9441
109 MQN 0.9438
110 4NC 0.9436
111 FBB 0.9434
112 4YO 0.9434
113 0TU 0.9434
114 3HM 0.9433
115 CWJ 0.9432
116 FBS 0.9430
117 15N 0.9430
118 3BU 0.9429
119 ET2 0.9424
120 36Y 0.9424
121 NNO 0.9419
122 SLS 0.9419
123 9R5 0.9419
124 3W8 0.9418
125 4A3 0.9417
126 SAN 0.9417
127 E7S 0.9417
128 4BL 0.9415
129 4JQ 0.9413
130 S7J 0.9413
131 0JD 0.9412
132 93K 0.9410
133 MYJ 0.9408
134 K4V 0.9408
135 FHB 0.9408
136 AEF 0.9407
137 03V 0.9405
138 JB5 0.9403
139 36R 0.9402
140 VGD 0.9401
141 AMS 0.9400
142 J6W 0.9399
143 GUA 0.9399
144 MS9 0.9397
145 6FZ 0.9397
146 4FS 0.9397
147 XX2 0.9394
148 ES5 0.9394
149 2AQ 0.9394
150 CHB 0.9391
151 FUD 0.9390
152 P9P 0.9389
153 ODO 0.9386
154 IHB 0.9385
155 5NU 0.9382
156 ONH 0.9381
157 JA8 0.9380
158 717 0.9376
159 4NZ 0.9375
160 3ZB 0.9374
161 UNJ 0.9373
162 AAS 0.9372
163 FQI 0.9367
164 TH7 0.9367
165 GOJ 0.9363
166 HMH 0.9362
167 4JL 0.9361
168 YRL 0.9360
169 E1T 0.9360
170 11S 0.9359
171 15E 0.9358
172 COU 0.9358
173 K97 0.9358
174 6RQ 0.9352
175 DVQ 0.9352
176 QSB 0.9351
177 AM4 0.9347
178 LPK 0.9346
179 9TW 0.9342
180 OCH 0.9339
181 5VM 0.9337
182 KJU 0.9332
183 9ZE 0.9331
184 428 0.9330
185 ABV 0.9329
186 4JT 0.9328
187 4JM 0.9325
188 DE5 0.9325
189 LR5 0.9325
190 IPB 0.9325
191 3AE 0.9321
192 TIU 0.9320
193 5GU 0.9320
194 AX7 0.9318
195 4CM 0.9316
196 2FY 0.9313
197 MAJ 0.9313
198 4JE 0.9312
199 J9Q 0.9312
200 DZA 0.9309
201 A5E 0.9308
202 H4N 0.9307
203 FK1 0.9299
204 YPN 0.9297
205 RBL 0.9296
206 97T 0.9293
207 9FL 0.9293
208 H8N 0.9292
209 8NY 0.9289
210 TTL 0.9288
211 3PF 0.9288
212 S0E 0.9285
213 2HC 0.9285
214 HHI 0.9285
215 SKA 0.9284
216 SYV 0.9281
217 5MI 0.9279
218 9CA 0.9274
219 ES9 0.9272
220 OW4 0.9265
221 5QY 0.9263
222 2QC 0.9260
223 GJP 0.9258
224 FBA 0.9254
225 OVP 0.9253
226 C2B 0.9251
227 W81 0.9251
228 R8S 0.9248
229 A7H 0.9247
230 3DM 0.9244
231 5MB 0.9241
232 CTL 0.9241
233 TYE 0.9239
234 KTJ 0.9238
235 NAG 0.9238
236 2K4 0.9237
237 5WV 0.9237
238 LNR 0.9235
239 HIS 0.9234
240 5H1 0.9232
241 14O 0.9230
242 S2G 0.9230
243 D48 0.9230
244 F60 0.9229
245 IFP 0.9228
246 CN0 0.9227
247 PIM 0.9227
248 6AI 0.9225
249 PKU 0.9224
250 XQ0 0.9222
251 1FD 0.9222
252 IV2 0.9221
253 SKM 0.9220
254 4RU 0.9219
255 2MI 0.9215
256 IWT 0.9211
257 ZXD 0.9211
258 XUL 0.9211
259 FYU 0.9210
260 14J 0.9210
261 1IT 0.9209
262 X0V 0.9207
263 36E 0.9205
264 PHU 0.9205
265 GO2 0.9204
266 GWM 0.9203
267 AN3 0.9201
268 OW7 0.9200
269 HHH 0.9198
270 HSO 0.9196
271 1SA 0.9195
272 270 0.9195
273 7VP 0.9194
274 7W1 0.9193
275 4I8 0.9188
276 AKG 0.9188
277 PO6 0.9180
278 M45 0.9180
279 RA7 0.9179
280 BZX 0.9177
281 X0U 0.9175
282 M3H 0.9175
283 CH9 0.9175
284 4FH 0.9172
285 N4E 0.9172
286 7BC 0.9171
287 TAG 0.9171
288 52C 0.9170
289 PH3 0.9170
290 NDH 0.9169
291 GDE 0.9168
292 DHK 0.9166
293 NF3 0.9165
294 SME 0.9165
295 AEG 0.9165
296 PIY 0.9165
297 4TU 0.9163
298 PQK 0.9163
299 1A7 0.9161
300 0BP 0.9161
301 1Z6 0.9160
302 1HN 0.9158
303 EN1 0.9156
304 8XL 0.9156
305 CFI 0.9156
306 8NB 0.9155
307 86L 0.9155
308 HA5 0.9154
309 2F6 0.9154
310 EUE 0.9153
311 4VY 0.9153
312 NIZ 0.9152
313 152 0.9150
314 K34 0.9148
315 BNF 0.9147
316 OKG 0.9147
317 SRT 0.9146
318 HX4 0.9146
319 XAZ 0.9145
320 Z13 0.9145
321 LDP 0.9144
322 EKZ 0.9144
323 795 0.9144
324 88L 0.9142
325 4SX 0.9142
326 QUS 0.9139
327 P9E 0.9138
328 173 0.9138
329 2HQ 0.9137
330 PPY 0.9136
331 8H8 0.9135
332 EYV 0.9134
333 KMH 0.9132
334 PAC 0.9132
335 HQJ 0.9131
336 3VS 0.9130
337 EVF 0.9130
338 9FE 0.9130
339 ISZ 0.9128
340 UA5 0.9127
341 TCA 0.9127
342 2BX 0.9126
343 HX3 0.9125
344 IFL 0.9125
345 4Z4 0.9124
346 R9Y 0.9124
347 86J 0.9123
348 VC3 0.9123
349 GLU 0.9121
350 27B 0.9119
351 92G 0.9118
352 492 0.9117
353 2FT 0.9117
354 OOG 0.9116
355 4XR 0.9115
356 7O4 0.9114
357 M4T 0.9113
358 G3E 0.9113
359 IAC 0.9112
360 ASC 0.9112
361 7W4 0.9111
362 BEZ 0.9111
363 N91 0.9110
364 FBM 0.9110
365 XRG 0.9110
366 L99 0.9110
367 BHO 0.9110
368 MPV 0.9109
369 NOY 0.9108
370 J5I 0.9106
371 7WG 0.9106
372 QWN 0.9104
373 HQT 0.9103
374 BNL 0.9103
375 SE2 0.9102
376 12Q 0.9102
377 AL0 0.9101
378 ESI 0.9101
379 5QX 0.9099
380 NFM 0.9099
381 I3A 0.9099
382 8K2 0.9098
383 ZYX 0.9098
384 GXY 0.9096
385 4LW 0.9096
386 DIN 0.9095
387 J9T 0.9092
388 KKN 0.9092
389 67N 0.9091
390 A29 0.9090
391 MAH 0.9090
392 N1E 0.9089
393 0NX 0.9089
394 3VX 0.9088
395 3ID 0.9088
396 RAT 0.9087
397 RM1 0.9086
398 ES7 0.9085
399 5JQ 0.9084
400 FHC 0.9084
401 OGA 0.9083
402 JAE 0.9081
403 GLC 0.9081
404 HMU 0.9080
405 MTL 0.9080
406 3HA 0.9078
407 3HG 0.9077
408 XM0 0.9077
409 FDR 0.9075
410 NOJ 0.9075
411 BQ2 0.9073
412 RHU 0.9072
413 OAA 0.9072
414 QXW 0.9070
415 MLT 0.9070
416 3R4 0.9068
417 SHA 0.9068
418 268 0.9067
419 BEN 0.9066
420 LT2 0.9065
421 E7Z 0.9064
422 J9N 0.9064
423 GLN 0.9063
424 6TZ 0.9063
425 0FN 0.9062
426 GGL 0.9061
427 GAB 0.9060
428 M2K 0.9059
429 B57 0.9058
430 PBC 0.9058
431 MRW 0.9057
432 DMD 0.9057
433 4HM 0.9057
434 HHA 0.9056
435 SSC 0.9055
436 SKF 0.9054
437 ALE 0.9053
438 I1E 0.9052
439 NSP 0.9052
440 4V2 0.9050
441 2HG 0.9049
442 KOJ 0.9048
443 TT4 0.9046
444 ZZT 0.9045
445 NCA 0.9041
446 PXL 0.9040
447 258 0.9038
448 KTW 0.9037
449 A7W 0.9037
450 FK8 0.9037
451 R20 0.9036
452 GF4 0.9036
453 OQC 0.9036
454 6VD 0.9035
455 ISN 0.9034
456 GZL 0.9033
457 BAM 0.9032
458 EA1 0.9031
459 NTN 0.9031
460 BGC 0.9031
461 ST3 0.9030
462 46P 0.9030
463 6PC 0.9030
464 363 0.9029
465 3M0 0.9029
466 5RO 0.9027
467 E4P 0.9027
468 TPA 0.9025
469 FGZ 0.9025
470 TSS 0.9024
471 6ME 0.9024
472 ICO 0.9021
473 HNL 0.9021
474 PJW 0.9020
475 P92 0.9020
476 GLO 0.9020
477 F9P 0.9020
478 QSH 0.9020
479 PHE 0.9019
480 WCE 0.9019
481 GJZ 0.9017
482 M6N 0.9015
483 HCI 0.9015
484 7MU 0.9012
485 NIO 0.9011
486 FAN 0.9011
487 N8Y 0.9009
488 CIT 0.9008
489 OVV 0.9008
490 M1A 0.9007
491 YZM 0.9007
492 3F0 0.9006
493 44W 0.9005
494 H4E 0.9004
495 CUW 0.9004
496 MZW 0.9004
497 BP9 0.9004
498 1L5 0.9003
499 NCT 0.9002
500 C2Y 0.9001
501 OK7 0.9001
502 KYA 0.9000
503 B62 0.9000
504 Q07 0.8999
505 L22 0.8998
506 NYL 0.8998
507 RD4 0.8998
508 24B 0.8996
509 MEW 0.8994
510 DQU 0.8992
511 5B1 0.8992
512 SOR 0.8992
513 ASO 0.8991
514 BZJ 0.8990
515 OTW 0.8989
516 MEV 0.8989
517 AHR 0.8989
518 Q24 0.8988
519 BDP 0.8988
520 92P 0.8987
521 N2Z 0.8986
522 URC 0.8985
523 KJH 0.8985
524 AOT 0.8984
525 BTY 0.8984
526 ZEC 0.8983
527 75K 0.8983
528 GNM 0.8983
529 2KA 0.8982
530 M5K 0.8982
531 DBH 0.8982
532 8WT 0.8979
533 G2F 0.8979
534 3W6 0.8978
535 3W3 0.8978
536 JBZ 0.8977
537 MET 0.8977
538 5XB 0.8977
539 XHP 0.8977
540 D3G 0.8976
541 BNS 0.8976
542 ACA 0.8976
543 SS1 0.8975
544 449 0.8973
545 UNU 0.8973
546 5RN 0.8970
547 4XV 0.8970
548 TYR 0.8970
549 7MW 0.8969
550 3HB 0.8969
551 6FB 0.8968
552 RBJ 0.8968
553 ZBT 0.8967
554 3QV 0.8967
555 GVG 0.8967
556 069 0.8963
557 F31 0.8963
558 54Z 0.8962
559 YCP 0.8961
560 PNP 0.8960
561 1P7 0.8960
562 SD4 0.8959
563 URO 0.8958
564 SEP 0.8958
565 8NX 0.8957
566 AZM 0.8956
567 82I 0.8955
568 C82 0.8954
569 L5V 0.8953
570 ANF 0.8952
571 AC0 0.8951
572 VGL 0.8951
573 DYA 0.8951
574 AA 0.8949
575 CXF 0.8949
576 AQO 0.8948
577 ONR 0.8948
578 4MB 0.8948
579 B55 0.8947
580 R8V 0.8946
581 3VQ 0.8946
582 DHI 0.8944
583 AJ2 0.8944
584 3AB 0.8944
585 PH2 0.8944
586 4HP 0.8943
587 FP1 0.8942
588 DGJ 0.8942
589 CK2 0.8941
590 2FQ 0.8941
591 4XS 0.8940
592 CFA 0.8940
593 IF7 0.8940
594 JG8 0.8940
595 SAL 0.8937
596 F02 0.8935
597 8TX 0.8935
598 4HC 0.8934
599 QBK 0.8934
600 BE2 0.8932
601 4CS 0.8932
602 2LY 0.8931
603 QSC 0.8931
604 PZA 0.8930
605 4NP 0.8929
606 QMP 0.8929
607 0FO 0.8929
608 THA 0.8927
609 2GS 0.8927
610 PBA 0.8927
611 RSO 0.8926
612 PD2 0.8924
613 PE0 0.8923
614 PEA 0.8923
615 MVN 0.8921
616 QBM 0.8920
617 2EC 0.8920
618 XIZ 0.8920
619 42J 0.8919
620 GAL 0.8918
621 2CK 0.8918
622 KMY 0.8916
623 CWS 0.8916
624 5JL 0.8915
625 DGN 0.8915
626 NBZ 0.8914
627 KUF 0.8913
628 0P6 0.8913
629 BE7 0.8913
630 XCG 0.8912
631 4SV 0.8911
632 DS0 0.8911
633 BEA 0.8911
634 44V 0.8910
635 PFL 0.8910
636 PEY 0.8910
637 4NS 0.8909
638 30G 0.8907
639 PRF 0.8906
640 FE DB1 0.8906
641 F1A 0.8905
642 JBK 0.8905
643 XDE 0.8905
644 1DW 0.8905
645 AAN 0.8905
646 7N0 0.8904
647 8GC 0.8904
648 1DV 0.8902
649 JAH 0.8901
650 SRO 0.8900
651 AZ8 0.8899
652 VNL 0.8897
653 XBT 0.8897
654 3QM 0.8896
655 4JU 0.8896
656 53C 0.8896
657 GZ2 0.8895
658 BRT 0.8895
659 UFV 0.8893
660 NPY 0.8893
661 QIV 0.8892
662 0F9 0.8892
663 P81 0.8891
664 TMG 0.8891
665 HHR 0.8890
666 5HN 0.8887
667 9NB 0.8887
668 92K 0.8886
669 ADA 0.8886
670 JND 0.8886
671 FLC 0.8885
672 2AL 0.8883
673 2MH 0.8883
674 DHY 0.8880
675 MNM 0.8880
676 GTR 0.8879
677 80G 0.8878
678 FDB 0.8878
679 QX4 0.8876
680 QUZ 0.8875
681 Z5P 0.8875
682 SSB 0.8875
683 DRL 0.8875
684 1XM 0.8874
685 5VL 0.8872
686 3PG 0.8870
687 1X4 0.8869
688 3NT 0.8869
689 YH7 0.8869
690 EE8 0.8868
691 FA1 0.8868
692 OHJ 0.8867
693 CXH 0.8866
694 K3D 0.8866
695 LMR 0.8866
696 G14 0.8866
697 0CU 0.8865
698 2FX 0.8865
699 DHC 0.8864
700 1CO 0.8863
701 0W1 0.8863
702 OHG 0.8861
703 4XF 0.8860
704 DDU 0.8860
705 3XR 0.8859
706 PZI 0.8859
707 AZ9 0.8859
708 B53 0.8858
709 XDK 0.8857
710 PRZ 0.8857
711 B85 0.8856
712 BCP 0.8853
713 GYE 0.8853
714 ZYR 0.8853
715 PQ0 0.8852
716 Y3L 0.8850
717 BPY 0.8849
718 8CM 0.8849
719 XXG 0.8849
720 45L 0.8849
721 IOS 0.8848
722 8HC 0.8846
723 EXD 0.8845
724 1PT 0.8845
725 8OZ 0.8845
726 3BZ 0.8843
727 URS 0.8843
728 JA5 0.8842
729 LDU 0.8842
730 61M 0.8841
731 NGA 0.8841
732 6QF 0.8840
733 EUG 0.8840
734 2O6 0.8839
735 INE 0.8837
736 0FK 0.8834
737 3U4 0.8834
738 3Z8 0.8834
739 3R6 0.8834
740 4MU 0.8833
741 DHS 0.8833
742 5TY 0.8831
743 AJV 0.8831
744 EOU 0.8830
745 DGL 0.8827
746 N3W 0.8825
747 ES6 0.8825
748 K82 0.8824
749 7ME 0.8823
750 ZZA 0.8821
751 RUY 0.8821
752 GP9 0.8820
753 QY9 0.8820
754 S2P 0.8820
755 MD6 0.8819
756 CCU 0.8819
757 1KP 0.8818
758 GCS 0.8818
759 SOE 0.8818
760 JKE 0.8817
761 PPT 0.8817
762 GLA 0.8817
763 HH5 0.8817
764 GVY 0.8815
765 PDC 0.8815
766 42A 0.8815
767 13P 0.8814
768 QIC 0.8814
769 FF2 0.8812
770 C53 0.8812
771 ODK 0.8812
772 0N7 0.8811
773 GCU 0.8810
774 PXY 0.8809
775 XAN 0.8809
776 ANC 0.8807
777 HQD 0.8807
778 BOA 0.8807
779 AZA 0.8807
780 2D0 0.8807
781 8W9 0.8806
782 8G0 0.8804
783 BML 0.8804
784 M58 0.8804
785 3OC 0.8804
786 ENO 0.8804
787 23A 0.8803
788 BBK 0.8802
789 X1R 0.8802
790 CWM 0.8802
791 TLA 0.8802
792 PRA 0.8800
793 R2B 0.8800
794 GXL 0.8800
795 261 0.8798
796 650 0.8798
797 PMB 0.8796
798 SWX 0.8795
799 KIB 0.8794
800 G3H 0.8793
801 P4B 0.8793
802 FBJ 0.8792
803 4CH 0.8791
804 9DG 0.8791
805 344 0.8789
806 NID 0.8789
807 LZM 0.8788
808 NLE 0.8788
809 39O 0.8787
810 PGH 0.8786
811 NDG 0.8786
812 P80 0.8786
813 H5B 0.8784
814 5GT 0.8784
815 NMJ 0.8782
816 KT7 0.8782
817 RIB 0.8781
818 FB2 0.8781
819 X6X 0.8780
820 S24 0.8778
821 ORN 0.8778
822 8S0 0.8777
823 HQE 0.8777
824 TTY 0.8776
825 6M9 0.8773
826 AJY 0.8771
827 TH0 0.8771
828 DRG 0.8770
829 HBO 0.8770
830 FTV 0.8770
831 1VK 0.8770
832 24W 0.8768
833 8IG 0.8768
834 YI6 0.8767
835 A2F 0.8767
836 6SD 0.8767
837 3SK 0.8765
838 LG4 0.8765
839 M5H 0.8764
840 E0O 0.8764
841 G3F 0.8764
842 PCR 0.8764
843 ASP 0.8763
844 QWW 0.8762
845 56D 0.8761
846 4JN 0.8760
847 25R 0.8759
848 CLZ 0.8756
849 EPR 0.8756
850 QBS 0.8755
851 PCA 0.8753
852 3FH 0.8753
853 GUN 0.8752
854 141 0.8751
855 AZG 0.8751
856 DEE 0.8751
857 2K8 0.8751
858 ES0 0.8749
859 HNH 0.8748
860 JBE 0.8747
861 VK3 0.8746
862 GAF 0.8746
863 DX4 0.8744
864 DNA 0.8743
865 535 0.8743
866 549 0.8741
867 6M4 0.8741
868 36M 0.8740
869 7WV 0.8740
870 IT2 0.8740
871 Q02 0.8739
872 A65 0.8735
873 J9W 0.8735
874 B1J 0.8735
875 4M4 0.8734
876 KJY 0.8733
877 G3P 0.8733
878 3SL 0.8732
879 0VT 0.8730
880 CSN 0.8730
881 Q88 0.8727
882 QX2 0.8727
883 SR1 0.8727
884 N2M 0.8726
885 H62 0.8726
886 6AP 0.8722
887 NQ 0.8720
888 4HS 0.8720
889 68A 0.8719
890 V1T 0.8718
891 VXX 0.8718
892 DTU 0.8718
893 IGA 0.8718
894 657 0.8716
895 P7Y 0.8716
896 PLQ 0.8716
897 AX3 0.8714
898 UFO 0.8714
899 CFP 0.8713
900 RMN 0.8711
901 F05 0.8711
902 IOL 0.8711
903 R1P 0.8710
904 2H5 0.8710
905 9BF 0.8710
906 GIF 0.8709
907 1WC 0.8709
908 S7S 0.8709
909 BIK 0.8708
910 K5W 0.8705
911 2AK 0.8703
912 HHS 0.8702
913 JRB 0.8702
914 HRM 0.8701
915 DA4 0.8701
916 PYD 0.8701
917 DNF 0.8699
918 AMC 0.8698
919 M4E 0.8697
920 ROI 0.8697
921 M1Q 0.8697
922 KQY 0.8696
923 LR8 0.8692
924 4LV 0.8690
925 RXA 0.8689
926 51R 0.8689
927 0RW 0.8689
928 M6W 0.8689
929 X48 0.8689
930 1WD 0.8688
931 9UL 0.8686
932 FPY 0.8679
933 7B4 0.8678
934 M1E 0.8678
935 290 0.8677
936 R2P 0.8676
937 HNT 0.8674
938 5MH 0.8671
939 IDM 0.8670
940 QBP 0.8670
941 MUA 0.8670
942 PEP 0.8669
943 1MC 0.8668
944 7FU 0.8665
945 SVN 0.8665
946 BP7 0.8665
947 1GN 0.8663
948 1SQ 0.8661
949 FB1 0.8661
950 HX2 0.8659
951 BVA 0.8658
952 0W8 0.8658
953 PBN 0.8657
954 5IQ 0.8657
955 PCS 0.8657
956 AG2 0.8656
957 VNJ 0.8655
958 GDL 0.8655
959 ITE 0.8652
960 149 0.8651
961 FPN 0.8651
962 FBV 0.8650
963 E3X 0.8650
964 IUR 0.8649
965 IND 0.8649
966 5SG 0.8647
967 GIV 0.8646
968 HLR 0.8646
969 2FG 0.8645
970 UY7 0.8645
971 43M 0.8645
972 VD9 0.8641
973 DA1 0.8639
974 TDR 0.8638
975 KW8 0.8638
976 PYF 0.8636
977 1NP 0.8635
978 R9S 0.8635
979 5Q0 0.8634
980 I2E 0.8633
981 5GV 0.8632
982 JP2 0.8631
983 5JC 0.8631
984 V55 0.8631
985 1LQ 0.8630
986 3IT 0.8630
987 LYS 0.8629
988 FBW 0.8628
989 IDH 0.8628
990 LXC 0.8628
991 P3K 0.8627
992 DEN 0.8627
993 JYB 0.8626
994 6GU 0.8625
995 3C4 0.8625
996 A5P 0.8624
997 7MX 0.8624
998 4JO 0.8623
999 6M1 0.8621
1000 5UC 0.8620
1001 BZI 0.8619
1002 JZ3 0.8618
1003 HJ7 0.8618
1004 XYP 0.8618
1005 OMD 0.8617
1006 9EW 0.8617
1007 MAE 0.8617
1008 HBX 0.8616
1009 4HO 0.8615
1010 PRO 0.8614
1011 4ME 0.8613
1012 PRL 0.8612
1013 9TZ 0.8612
1014 4YS 0.8612
1015 ES1 0.8611
1016 LZ1 0.8611
1017 N7I 0.8611
1018 5OO 0.8610
1019 7WR 0.8610
1020 EVA 0.8609
1021 680 0.8609
1022 JZ2 0.8608
1023 GTQ 0.8608
1024 ADZ 0.8607
1025 FQX 0.8606
1026 SHG 0.8606
1027 FPI 0.8605
1028 GZ3 0.8605
1029 3XX 0.8605
1030 RYV 0.8598
1031 XYD 0.8597
1032 37T 0.8596
1033 6F0 0.8595
1034 MPI 0.8595
1035 DFB 0.8594
1036 5M0 0.8594
1037 OHP 0.8594
1038 209 0.8593
1039 C21 0.8593
1040 BZE 0.8592
1041 MCT 0.8592
1042 5RG 0.8592
1043 XBZ 0.8591
1044 3J8 0.8590
1045 0R0 0.8590
1046 F0J 0.8588
1047 URF 0.8587
1048 MWJ 0.8586
1049 GRE 0.8585
1050 PQZ 0.8585
1051 MZG 0.8585
1052 7VS 0.8583
1053 SIN 0.8582
1054 ABN 0.8579
1055 27Y 0.8577
1056 IQ5 0.8572
1057 4JP 0.8572
1058 54G 0.8569
1059 4JJ 0.8568
1060 2MP 0.8568
1061 4CL 0.8565
1062 JPZ 0.8564
1063 JTH 0.8564
1064 2AC 0.8563
1065 QPR 0.8560
1066 BZF 0.8559
1067 ICP 0.8555
1068 FUM 0.8553
1069 TLD 0.8552
1070 PYQ 0.8550
1071 WBU 0.8548
1072 0XT 0.8548
1073 JZ5 0.8546
1074 PY7 0.8542
1075 M78 0.8538
1076 SYN 0.8538
1077 K32 0.8535
1078 4ZE 0.8531
1079 MZT 0.8530
1080 APG 0.8524
1081 HSM 0.8523
1082 M0Q 0.8511
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 4DNJ; Ligand: ANN; 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: 4dnj.bio1) has 11 residues
No: Leader PDB Ligand Sequence Similarity
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