Receptor
PDB id Resolution Class Description Source Keywords
3PCM 2.25 Å EC: 1.13.11.3 STRUCTURE OF PROTOCATECHUATE 3,4-DIOXYGENASE COMPLEXED WITH HYDROXYNICOTINIC ACID N-OXIDE AND CYANIDE PSEUDOMONAS PUTIDA DIOXYGENASE IRON NONHEME METALLOPROTEIN OXIDOREDUCTASE TRANSITION-STATE ANALOG COMPLEX
Ref.: CRYSTAL STRUCTURES OF SUBSTRATE AND SUBSTRATE ANALO COMPLEXES OF PROTOCATECHUATE 3,4-DIOXYGENASE: ENDOG FE3+ LIGAND DISPLACEMENT IN RESPONSE TO SUBSTRATE B BIOCHEMISTRY V. 36 10052 1997
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
CYN M:575;
N:575;
O:575;
P:575;
Q:575;
R:575;
 Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
 none;
none;
none;
none;
none;
none;
 submit data
26.017 C N [C-]#...
FE M:600;
N:600;
O:600;
P:600;
Q:600;
R:600;
 Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
 none;
none;
none;
none;
none;
none;
 submit data
55.845 Fe [Fe+3...
NNO M:550;
N:550;
O:550;
P:550;
Q:550;
R:550;
 Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
 none;
none;
none;
none;
none;
none;
 submit data
155.108 C6 H5 N O4 c1cc(...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
3PCJ 2.13 Å EC: 1.13.11.3 STRUCTURE OF PROTOCATECHUATE 3,4-DIOXYGENASE COMPLEXED WITH HYDROXYISONICOTINIC ACID N-OXIDE PSEUDOMONAS PUTIDA DIOXYGENASE IRON NONHEME METALLOPROTEIN OXIDOREDUCTASE TRANSITION-STATE ANALOG COMPLEX
Ref.: CRYSTAL STRUCTURES OF SUBSTRATE AND SUBSTRATE ANALO COMPLEXES OF PROTOCATECHUATE 3,4-DIOXYGENASE: ENDOG FE3+ LIGAND DISPLACEMENT IN RESPONSE TO SUBSTRATE B BIOCHEMISTRY V. 36 10052 1997
Members (16)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 3PCJ Kd = 0.06 uM INO C6 H5 N O4 c1c[n+](c(....
2 3PCN Kd = 220 uM DHY C8 H8 O4 c1cc(c(cc1....
3 1YKN - DHB C7 H6 O4 c1cc(c(cc1....
4 1YKL Kd = 57 uM DHB C7 H6 O4 c1cc(c(cc1....
5 3PCL - INO C6 H5 N O4 c1c[n+](c(....
6 3PCK Kd = 0.2 uM NNO C6 H5 N O4 c1cc([n+](....
7 1YKP Kd = 1100 uM DHB C7 H6 O4 c1cc(c(cc1....
8 3PCH Ki = 4 uM CHB C7 H5 Cl O3 c1cc(c(cc1....
9 3PCM - NNO C6 H5 N O4 c1cc([n+](....
10 3PCE Ki = 10 mM 3HP C8 H8 O3 c1cc(cc(c1....
11 3PCA - DHB C7 H6 O4 c1cc(c(cc1....
12 3PCF Ki = 0.9 uM FHB C7 H5 F O3 c1cc(c(cc1....
13 3PCB Ki = 4 mM 3HB C7 H6 O3 c1cc(cc(c1....
14 3PCG Ki = 5 mM 4HP C8 H8 O3 c1cc(ccc1C....
15 3PCC Ki = 240 uM PHB C7 H6 O3 c1cc(ccc1C....
16 3PCI - IHB C7 H5 I O3 c1cc(c(cc1....
70% Homology Family (16)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 3PCJ Kd = 0.06 uM INO C6 H5 N O4 c1c[n+](c(....
2 3PCN Kd = 220 uM DHY C8 H8 O4 c1cc(c(cc1....
3 1YKN - DHB C7 H6 O4 c1cc(c(cc1....
4 1YKL Kd = 57 uM DHB C7 H6 O4 c1cc(c(cc1....
5 3PCL - INO C6 H5 N O4 c1c[n+](c(....
6 3PCK Kd = 0.2 uM NNO C6 H5 N O4 c1cc([n+](....
7 1YKP Kd = 1100 uM DHB C7 H6 O4 c1cc(c(cc1....
8 3PCH Ki = 4 uM CHB C7 H5 Cl O3 c1cc(c(cc1....
9 3PCM - NNO C6 H5 N O4 c1cc([n+](....
10 3PCE Ki = 10 mM 3HP C8 H8 O3 c1cc(cc(c1....
11 3PCA - DHB C7 H6 O4 c1cc(c(cc1....
12 3PCF Ki = 0.9 uM FHB C7 H5 F O3 c1cc(c(cc1....
13 3PCB Ki = 4 mM 3HB C7 H6 O3 c1cc(cc(c1....
14 3PCG Ki = 5 mM 4HP C8 H8 O3 c1cc(ccc1C....
15 3PCC Ki = 240 uM PHB C7 H6 O3 c1cc(ccc1C....
16 3PCI - IHB C7 H5 I O3 c1cc(c(cc1....
50% Homology Family (21)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 3PCJ Kd = 0.06 uM INO C6 H5 N O4 c1c[n+](c(....
2 3PCN Kd = 220 uM DHY C8 H8 O4 c1cc(c(cc1....
3 1YKN - DHB C7 H6 O4 c1cc(c(cc1....
4 1YKL Kd = 57 uM DHB C7 H6 O4 c1cc(c(cc1....
5 3PCL - INO C6 H5 N O4 c1c[n+](c(....
6 3PCK Kd = 0.2 uM NNO C6 H5 N O4 c1cc([n+](....
7 1YKP Kd = 1100 uM DHB C7 H6 O4 c1cc(c(cc1....
8 3PCH Ki = 4 uM CHB C7 H5 Cl O3 c1cc(c(cc1....
9 3PCM - NNO C6 H5 N O4 c1cc([n+](....
10 3PCE Ki = 10 mM 3HP C8 H8 O3 c1cc(cc(c1....
11 3PCA - DHB C7 H6 O4 c1cc(c(cc1....
12 3PCF Ki = 0.9 uM FHB C7 H5 F O3 c1cc(c(cc1....
13 3PCB Ki = 4 mM 3HB C7 H6 O3 c1cc(cc(c1....
14 3PCG Ki = 5 mM 4HP C8 H8 O3 c1cc(ccc1C....
15 3PCC Ki = 240 uM PHB C7 H6 O3 c1cc(ccc1C....
16 3PCI - IHB C7 H5 I O3 c1cc(c(cc1....
17 2BUR - PHB C7 H6 O3 c1cc(ccc1C....
18 2BUQ - CAQ C6 H6 O2 c1ccc(c(c1....
19 1EOB - DHB C7 H6 O4 c1cc(c(cc1....
20 2BUV Kd = 100 uM DHB C7 H6 O4 c1cc(c(cc1....
21 1EOC Ki = 0.9 uM 4NC C6 H5 N O4 c1cc(c(cc1....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: NNO; Similar ligands found: 2
No: Ligand ECFP6 Tc MDL keys Tc
1 NNO 1 1
2 INO 0.414634 0.975
Similar Ligands (3D)
Ligand no: 1; Ligand: NNO; Similar ligands found: 1338
No: Ligand Similarity coefficient
1 4A3 1.0000
2 4NC 1.0000
3 DHB 1.0000
4 3HM 1.0000
5 XX2 1.0000
6 FHB 1.0000
7 93K 1.0000
8 2HO 1.0000
9 MYJ 1.0000
10 JLZ 1.0000
11 P9P 0.9986
12 CHB 0.9981
13 9TW 0.9974
14 QSB 0.9907
15 IHB 0.9864
16 HBD 0.9805
17 PHB 0.9787
18 4CS 0.9773
19 F31 0.9768
20 GDE 0.9764
21 3HB 0.9746
22 PAB 0.9746
23 NPO 0.9743
24 0HN 0.9734
25 VNL 0.9723
26 GAB 0.9714
27 1Y6 0.9712
28 4MA 0.9712
29 8WO 0.9711
30 0HO 0.9697
31 3NT 0.9685
32 WCE 0.9682
33 6NT 0.9679
34 3A9 0.9674
35 OVV 0.9669
36 826 0.9668
37 SKM 0.9666
38 3AB 0.9665
39 PBZ 0.9665
40 2ZM 0.9660
41 X0V 0.9659
42 4FH 0.9657
43 AC6 0.9651
44 2HU 0.9646
45 4ZA 0.9642
46 3NY 0.9641
47 8GC 0.9641
48 P72 0.9640
49 5HN 0.9639
50 ABI 0.9638
51 4AA 0.9634
52 53C 0.9634
53 DHK 0.9634
54 JAW 0.9628
55 GYE 0.9624
56 4XR 0.9622
57 1F1 0.9621
58 4P5 0.9616
59 EKZ 0.9612
60 5NI 0.9608
61 E7Z 0.9607
62 5WV 0.9602
63 6NI 0.9601
64 PHU 0.9599
65 174 0.9594
66 BGC 0.9592
67 KOJ 0.9591
68 4SX 0.9591
69 M4T 0.9590
70 Z82 0.9590
71 SW7 0.9589
72 JDN 0.9586
73 FGZ 0.9584
74 BRT 0.9578
75 5XC 0.9575
76 JB8 0.9573
77 IFP 0.9571
78 4Z4 0.9569
79 3PF 0.9569
80 LDP 0.9568
81 KKN 0.9567
82 QSH 0.9566
83 5QY 0.9566
84 ISN 0.9561
85 4WL 0.9559
86 L99 0.9554
87 3BZ 0.9553
88 5OB 0.9552
89 J9T 0.9539
90 ES7 0.9537
91 2AL 0.9532
92 FA0 0.9529
93 3ID 0.9527
94 BEN 0.9526
95 PZI 0.9524
96 BZ3 0.9522
97 GZL 0.9522
98 BZ2 0.9519
99 DOB 0.9519
100 BEZ 0.9519
101 5NU 0.9518
102 CFI 0.9517
103 BDP 0.9517
104 NMJ 0.9514
105 5RN 0.9513
106 GLC 0.9503
107 TTL 0.9502
108 LT2 0.9498
109 R8V 0.9498
110 86J 0.9497
111 12Q 0.9497
112 7W1 0.9497
113 NCA 0.9497
114 H42 0.9497
115 5CU 0.9495
116 3HA 0.9494
117 PBC 0.9493
118 DBH 0.9484
119 ICO 0.9483
120 7W4 0.9481
121 VXX 0.9481
122 G3E 0.9479
123 5RG 0.9478
124 4M0 0.9477
125 SYV 0.9476
126 D48 0.9475
127 BHA 0.9472
128 SAL 0.9468
129 5QX 0.9466
130 FAN 0.9465
131 KJH 0.9465
132 HX3 0.9465
133 M2K 0.9465
134 2HQ 0.9463
135 GTQ 0.9463
136 DMD 0.9459
137 67N 0.9459
138 5RO 0.9458
139 ISZ 0.9458
140 ICB 0.9454
141 M1A 0.9454
142 SE2 0.9452
143 BE2 0.9452
144 J5I 0.9451
145 E1T 0.9451
146 BAM 0.9446
147 COU 0.9441
148 TWO 0.9441
149 EA1 0.9440
150 069 0.9438
151 XIY 0.9438
152 HBA 0.9438
153 JB5 0.9436
154 6PC 0.9436
155 DIN 0.9435
156 2BG 0.9435
157 3F0 0.9435
158 SKA 0.9435
159 4XV 0.9434
160 HDH 0.9433
161 HA5 0.9431
162 KUF 0.9429
163 HQT 0.9429
164 15N 0.9429
165 AHR 0.9429
166 AZ9 0.9427
167 HQJ 0.9427
168 Q88 0.9424
169 03V 0.9421
170 0JD 0.9421
171 RSO 0.9421
172 ANN 0.9419
173 NIO 0.9418
174 NOJ 0.9416
175 4SV 0.9415
176 OCH 0.9413
177 0P6 0.9413
178 HIS 0.9413
179 GTR 0.9413
180 ES5 0.9412
181 92K 0.9411
182 E5X 0.9411
183 FP1 0.9410
184 TPA 0.9410
185 A7W 0.9409
186 L5V 0.9409
187 5M0 0.9409
188 6CS 0.9408
189 1LQ 0.9406
190 CWS 0.9405
191 ORO 0.9404
192 UNU 0.9404
193 ET2 0.9403
194 FE DB1 0.9403
195 ABV 0.9402
196 AC0 0.9401
197 OAA 0.9398
198 J9Q 0.9398
199 2AQ 0.9397
200 3OC 0.9396
201 ES0 0.9394
202 4M4 0.9394
203 24W 0.9394
204 YCP 0.9394
205 FBW 0.9393
206 PNZ 0.9393
207 HQD 0.9392
208 FBB 0.9391
209 SAN 0.9391
210 MLT 0.9391
211 1M2 0.9390
212 3M0 0.9390
213 1SQ 0.9389
214 4FA 0.9389
215 54G 0.9386
216 AX7 0.9385
217 ESP 0.9385
218 4FS 0.9384
219 V55 0.9384
220 K2T 0.9383
221 NTN 0.9383
222 4J8 0.9382
223 MS9 0.9381
224 6RQ 0.9381
225 JBK 0.9380
226 173 0.9380
227 EUG 0.9380
228 9TZ 0.9380
229 52C 0.9377
230 JBH 0.9376
231 270 0.9375
232 F9Y 0.9375
233 8CM 0.9375
234 BEA 0.9374
235 CWM 0.9374
236 0N7 0.9373
237 97T 0.9373
238 D1X 0.9373
239 15L 0.9371
240 5SG 0.9370
241 9FE 0.9370
242 3IT 0.9370
243 3MB 0.9369
244 PIY 0.9369
245 OVM 0.9368
246 5IQ 0.9368
247 2MI 0.9367
248 1NP 0.9367
249 N5J 0.9366
250 TYL 0.9366
251 NBZ 0.9366
252 BHO 0.9365
253 JPZ 0.9362
254 TIU 0.9360
255 BPN 0.9359
256 LNR 0.9358
257 34D 0.9357
258 MRW 0.9357
259 VGL 0.9357
260 SS1 0.9356
261 1P7 0.9355
262 717 0.9355
263 92P 0.9354
264 ESX 0.9354
265 ES6 0.9354
266 7WR 0.9353
267 DNF 0.9352
268 45L 0.9352
269 PZA 0.9351
270 TH7 0.9351
271 UGC 0.9349
272 XM0 0.9349
273 4HM 0.9348
274 G3F 0.9348
275 8WT 0.9347
276 O72 0.9346
277 UFV 0.9346
278 1LM 0.9345
279 ES1 0.9344
280 5MK 0.9344
281 ES2 0.9343
282 QWN 0.9343
283 9FL 0.9342
284 FBS 0.9342
285 0W8 0.9342
286 CTL 0.9340
287 CLW 0.9339
288 DYA 0.9339
289 0F9 0.9339
290 2FY 0.9338
291 TSU 0.9338
292 I3A 0.9336
293 AW5 0.9334
294 PEA 0.9334
295 OXC 0.9332
296 4YS 0.9332
297 7HQ 0.9332
298 14O 0.9331
299 F0J 0.9330
300 PXL 0.9329
301 DHR 0.9328
302 MQN 0.9328
303 4XS 0.9327
304 SOE 0.9327
305 6TZ 0.9326
306 8S0 0.9325
307 5H1 0.9324
308 PIM 0.9324
309 9CA 0.9321
310 ODO 0.9321
311 BE7 0.9319
312 Q6T 0.9319
313 1IT 0.9318
314 BZX 0.9318
315 NIZ 0.9318
316 A29 0.9316
317 3U4 0.9315
318 4BZ 0.9315
319 DGJ 0.9313
320 P92 0.9311
321 6FZ 0.9311
322 IV2 0.9310
323 F60 0.9309
324 5Q0 0.9309
325 4JQ 0.9309
326 MSR 0.9309
327 5MI 0.9308
328 51R 0.9308
329 FOT 0.9306
330 2LY 0.9305
331 OGA 0.9305
332 C2Y 0.9302
333 PAC 0.9302
334 42C 0.9301
335 36R 0.9301
336 FYU 0.9301
337 4VP 0.9301
338 HQY 0.9300
339 VGD 0.9300
340 2A9 0.9300
341 2K4 0.9300
342 DHS 0.9300
343 FCR 0.9300
344 JAE 0.9299
345 JKE 0.9298
346 5MB 0.9297
347 QUZ 0.9297
348 NPY 0.9295
349 HMH 0.9295
350 ESI 0.9294
351 F4E 0.9293
352 FBM 0.9293
353 GUA 0.9288
354 GVG 0.9287
355 AL0 0.9286
356 6AI 0.9285
357 DOR 0.9283
358 SX1 0.9281
359 7NI 0.9281
360 QXW 0.9281
361 MR1 0.9281
362 8ZE 0.9280
363 XQ0 0.9279
364 82I 0.9279
365 KTW 0.9278
366 2D0 0.9277
367 GAL 0.9277
368 5B1 0.9276
369 K97 0.9275
370 QIC 0.9275
371 JA8 0.9273
372 7MU 0.9273
373 12T 0.9273
374 HHA 0.9270
375 H8N 0.9270
376 RM1 0.9269
377 OK7 0.9267
378 K34 0.9266
379 6M9 0.9265
380 JFJ 0.9265
381 SLS 0.9264
382 9ZE 0.9264
383 FA1 0.9264
384 UNC 0.9263
385 AEF 0.9263
386 1P8 0.9261
387 0TU 0.9261
388 3XX 0.9260
389 TZF 0.9259
390 42J 0.9257
391 M1Q 0.9257
392 C1M 0.9255
393 I1E 0.9255
394 HC4 0.9253
395 XCZ 0.9252
396 YRL 0.9252
397 CXF 0.9252
398 GCU 0.9248
399 5VM 0.9247
400 4ME 0.9247
401 CPZ 0.9247
402 7WV 0.9245
403 0W1 0.9244
404 N8Y 0.9242
405 SNU 0.9242
406 F05 0.9241
407 5LA 0.9240
408 XXG 0.9240
409 ONR 0.9238
410 LZM 0.9237
411 261 0.9237
412 ADA 0.9237
413 ZXD 0.9235
414 4YO 0.9234
415 AMS 0.9232
416 11S 0.9231
417 SHA 0.9230
418 F9P 0.9230
419 M58 0.9227
420 ASO 0.9227
421 KJU 0.9226
422 OW4 0.9225
423 ES9 0.9224
424 4XH 0.9224
425 AKG 0.9223
426 AKH 0.9221
427 AAS 0.9220
428 2HC 0.9220
429 149 0.9219
430 4NM 0.9218
431 8XL 0.9218
432 LMR 0.9217
433 1P3 0.9217
434 4JM 0.9216
435 7B4 0.9216
436 3Z8 0.9215
437 DHY 0.9211
438 39O 0.9210
439 42A 0.9209
440 MZG 0.9209
441 HJP 0.9209
442 6M4 0.9209
443 1PT 0.9209
444 MAJ 0.9208
445 R20 0.9206
446 G4D 0.9205
447 MCT 0.9205
448 IJZ 0.9203
449 15E 0.9202
450 GCS 0.9201
451 0FK 0.9200
452 4HO 0.9199
453 URC 0.9199
454 DE5 0.9198
455 PRZ 0.9198
456 4JT 0.9197
457 RAT 0.9196
458 4CL 0.9196
459 2H5 0.9196
460 SN4 0.9195
461 9EW 0.9192
462 ADE 0.9192
463 ASC 0.9191
464 27Y 0.9190
465 8HC 0.9188
466 M3H 0.9188
467 QSC 0.9188
468 2CK 0.9188
469 IT2 0.9188
470 HH8 0.9187
471 C2U 0.9186
472 BSX 0.9185
473 J9N 0.9185
474 IF7 0.9185
475 SVN 0.9184
476 EXD 0.9183
477 KBB 0.9182
478 IPB 0.9180
479 8H8 0.9180
480 TTY 0.9180
481 2FG 0.9179
482 4JJ 0.9178
483 SWD 0.9177
484 AX3 0.9177
485 G6D 0.9177
486 M0W 0.9176
487 J9W 0.9175
488 OTR 0.9174
489 M6N 0.9173
490 MWJ 0.9173
491 NDH 0.9173
492 1MC 0.9173
493 SVD 0.9171
494 M4E 0.9170
495 0RW 0.9170
496 MPV 0.9168
497 23A 0.9167
498 KT7 0.9166
499 2AC 0.9166
500 PD2 0.9165
501 CN0 0.9165
502 1WD 0.9165
503 XYP 0.9165
504 BR9 0.9163
505 FQI 0.9163
506 AMC 0.9162
507 XYD 0.9161
508 XBZ 0.9161
509 GLA 0.9161
510 H4N 0.9160
511 OVP 0.9160
512 HPS 0.9160
513 GAF 0.9159
514 R9S 0.9159
515 JG8 0.9157
516 HLR 0.9157
517 URF 0.9157
518 FK1 0.9156
519 XHP 0.9156
520 ZYR 0.9154
521 APZ 0.9153
522 K5W 0.9153
523 QBK 0.9152
524 N2I 0.9149
525 TH0 0.9148
526 GIV 0.9148
527 275 0.9146
528 UNJ 0.9146
529 JZ2 0.9145
530 EYK 0.9145
531 Q24 0.9143
532 TSS 0.9143
533 Z5P 0.9141
534 2HG 0.9141
535 GLU 0.9140
536 44W 0.9140
537 EDR 0.9139
538 36E 0.9139
539 B62 0.9139
540 FDB 0.9138
541 FBV 0.9138
542 NSP 0.9138
543 XX3 0.9137
544 75K 0.9137
545 WBU 0.9137
546 FB2 0.9136
547 OMD 0.9136
548 5JC 0.9135
549 HPA 0.9135
550 MBG 0.9134
551 4HC 0.9133
552 GRE 0.9132
553 2FQ 0.9131
554 PBA 0.9131
555 6M1 0.9131
556 RHU 0.9130
557 CH9 0.9130
558 FA3 0.9129
559 ASP 0.9128
560 259 0.9127
561 PE0 0.9127
562 4ZE 0.9126
563 DQU 0.9126
564 3FH 0.9126
565 AZ8 0.9126
566 TGX 0.9125
567 S2G 0.9123
568 GF4 0.9122
569 XAZ 0.9121
570 PEY 0.9120
571 PDC 0.9120
572 OTW 0.9120
573 AJ2 0.9120
574 FB1 0.9120
575 MWP 0.9119
576 IAC 0.9119
577 2LP 0.9118
578 P3K 0.9118
579 A5E 0.9117
580 XQG 0.9117
581 VNJ 0.9117
582 2O6 0.9116
583 MWM 0.9115
584 1A7 0.9115
585 PMB 0.9115
586 5MH 0.9115
587 PYF 0.9114
588 LXC 0.9113
589 2YU 0.9112
590 M0Q 0.9110
591 37T 0.9110
592 JBE 0.9109
593 QOS 0.9108
594 A1U 0.9108
595 QX2 0.9108
596 7VS 0.9108
597 2EC 0.9108
598 QPR 0.9107
599 B57 0.9106
600 ADZ 0.9106
601 428 0.9105
602 KTA 0.9104
603 LGC 0.9104
604 IWT 0.9102
605 M1H 0.9102
606 5GU 0.9101
607 A13 0.9100
608 34A 0.9100
609 N3W 0.9099
610 5WY 0.9099
611 CTS 0.9099
612 ORN 0.9098
613 JND 0.9097
614 KYA 0.9096
615 N2Z 0.9096
616 HMU 0.9095
617 FPI 0.9095
618 TDR 0.9094
619 JTH 0.9094
620 AJY 0.9093
621 DEN 0.9093
622 6ME 0.9093
623 NK 0.9092
624 RIB 0.9090
625 X6X 0.9090
626 GJP 0.9089
627 BTY 0.9089
628 2MP 0.9089
629 AJV 0.9088
630 1DW 0.9088
631 KDV 0.9085
632 94W 0.9085
633 1GN 0.9085
634 M5K 0.9084
635 QWW 0.9083
636 HHI 0.9083
637 5JQ 0.9082
638 DIU 0.9082
639 GUN 0.9081
640 10L 0.9081
641 XAN 0.9081
642 8G0 0.9080
643 6KT 0.9080
644 DBX 0.9079
645 4RU 0.9078
646 FDR 0.9076
647 43M 0.9076
648 TCA 0.9076
649 AQO 0.9075
650 DHQ 0.9075
651 0R0 0.9074
652 TOF 0.9073
653 JZ3 0.9073
654 FBA 0.9073
655 QY9 0.9073
656 4MU 0.9072
657 MEW 0.9072
658 0FO 0.9072
659 PEP 0.9071
660 HBX 0.9070
661 14J 0.9070
662 NID 0.9069
663 G2F 0.9069
664 8NX 0.9066
665 GXL 0.9064
666 KJY 0.9064
667 268 0.9062
668 INE 0.9061
669 5UC 0.9061
670 6MP 0.9061
671 8TX 0.9060
672 QMP 0.9059
673 25W 0.9059
674 463 0.9058
675 G5V 0.9058
676 7WG 0.9058
677 ICP 0.9058
678 PYD 0.9058
679 M45 0.9058
680 1HN 0.9057
681 GLN 0.9057
682 0FN 0.9057
683 S76 0.9056
684 4BY 0.9055
685 GXY 0.9054
686 C2B 0.9053
687 3DO 0.9052
688 36Y 0.9051
689 3DM 0.9051
690 NCT 0.9051
691 IND 0.9050
692 4JL 0.9050
693 R8S 0.9049
694 4ZC 0.9049
695 HLZ 0.9046
696 4NB 0.9046
697 PJW 0.9046
698 1SA 0.9046
699 QX4 0.9045
700 1AL 0.9043
701 GV9 0.9043
702 9MG 0.9043
703 AZA 0.9041
704 2CQ 0.9041
705 EVA 0.9040
706 CWJ 0.9039
707 BCU 0.9038
708 ABN 0.9038
709 BZI 0.9038
710 M1E 0.9038
711 XBT 0.9037
712 8NY 0.9036
713 MUA 0.9036
714 9DG 0.9035
715 6F0 0.9034
716 8OZ 0.9034
717 HY1 0.9033
718 F12 0.9033
719 SYN 0.9032
720 3ZB 0.9031
721 ZZT 0.9031
722 3AL 0.9030
723 SRT 0.9030
724 9R5 0.9030
725 HT4 0.9028
726 GOJ 0.9028
727 9DA 0.9027
728 2F6 0.9025
729 LQ2 0.9024
730 LZ1 0.9024
731 24B 0.9024
732 44V 0.9023
733 FDK 0.9023
734 IFL 0.9021
735 GCB 0.9021
736 7WA 0.9021
737 Q02 0.9021
738 SHG 0.9021
739 PO6 0.9020
740 3Z7 0.9020
741 4BL 0.9018
742 XXP 0.9018
743 9HX 0.9017
744 MJ2 0.9017
745 23J 0.9017
746 32X 0.9016
747 B55 0.9014
748 7HP 0.9013
749 3SK 0.9013
750 RXA 0.9012
751 J6W 0.9012
752 BZF 0.9011
753 TEP 0.9010
754 BNS 0.9010
755 4V2 0.9010
756 VK3 0.9010
757 H4E 0.9009
758 6GU 0.9009
759 GAG 0.9009
760 4JP 0.9009
761 2A7 0.9008
762 NQ 0.9008
763 MT0 0.9008
764 2AK 0.9006
765 BP1 0.9005
766 495 0.9004
767 PKU 0.9004
768 AMH 0.9004
769 XDK 0.9004
770 DNC 0.9004
771 GIF 0.9004
772 XRG 0.9002
773 MVN 0.9002
774 TT4 0.9002
775 B85 0.9002
776 4TU 0.9001
777 FBU 0.9001
778 IDM 0.9001
779 T6C 0.8999
780 CFP 0.8998
781 5JL 0.8998
782 NOY 0.8997
783 PRA 0.8997
784 E7S 0.8996
785 M4S 0.8995
786 PY7 0.8995
787 0BP 0.8995
788 EV0 0.8994
789 BTE 0.8994
790 TM7 0.8993
791 GJZ 0.8992
792 A2F 0.8992
793 209 0.8991
794 M1Z 0.8990
795 NBE 0.8990
796 EVF 0.8990
797 AZG 0.8990
798 AY4 0.8990
799 TLD 0.8990
800 LCN 0.8989
801 EOL 0.8988
802 1KP 0.8986
803 4JC 0.8986
804 BNF 0.8985
805 FUD 0.8985
806 SWA 0.8985
807 7ZE 0.8983
808 URO 0.8983
809 141 0.8983
810 150 0.8982
811 3HP 0.8982
812 COI 0.8981
813 6AP 0.8981
814 H7Y 0.8980
815 1XN 0.8980
816 F81 0.8979
817 IGA 0.8979
818 BPY 0.8979
819 69O 0.8977
820 PHE 0.8977
821 AN3 0.8976
822 DX4 0.8976
823 9KT 0.8975
824 Y8I 0.8974
825 282 0.8972
826 HH5 0.8972
827 0CT 0.8971
828 3QM 0.8970
829 GO2 0.8970
830 OHP 0.8970
831 DEE 0.8966
832 I3E 0.8966
833 7ME 0.8965
834 URS 0.8965
835 NAG 0.8964
836 3R6 0.8962
837 HIO 0.8960
838 YH7 0.8959
839 2ZV 0.8959
840 VOH 0.8956
841 HSM 0.8956
842 FPY 0.8956
843 4AV 0.8955
844 MPI 0.8955
845 GVH 0.8953
846 CFF 0.8950
847 0R1 0.8949
848 4JO 0.8949
849 8W9 0.8948
850 JIF 0.8948
851 EGR 0.8948
852 UAN 0.8947
853 PYQ 0.8944
854 ES4 0.8944
855 RMN 0.8943
856 BNL 0.8942
857 LI6 0.8938
858 FH2 0.8938
859 DRL 0.8938
860 RB5 0.8937
861 258 0.8936
862 8NB 0.8936
863 7MX 0.8936
864 GCO 0.8936
865 IUR 0.8935
866 290 0.8935
867 MZB 0.8935
868 60P 0.8933
869 LDU 0.8933
870 4P0 0.8932
871 B53 0.8931
872 7VP 0.8930
873 XDE 0.8930
874 TC7 0.8930
875 9X7 0.8929
876 L22 0.8929
877 SOR 0.8929
878 APG 0.8929
879 3C4 0.8928
880 OXQ 0.8927
881 7N0 0.8927
882 2ZQ 0.8926
883 PH2 0.8926
884 AS3 0.8924
885 0CU 0.8924
886 PM6 0.8924
887 KBG 0.8923
888 R9Y 0.8923
889 1WG 0.8922
890 AGK 0.8922
891 3MG 0.8922
892 3WA 0.8921
893 PFB 0.8921
894 6R8 0.8919
895 3SL 0.8918
896 LYL 0.8916
897 C21 0.8916
898 ZBT 0.8916
899 FK8 0.8915
900 SNO 0.8915
901 RAM 0.8915
902 HZQ 0.8912
903 ZZ3 0.8912
904 GZ3 0.8911
905 H62 0.8909
906 DGL 0.8907
907 PRF 0.8907
908 F4Z 0.8907
909 KBZ 0.8907
910 BZJ 0.8906
911 AEH 0.8906
912 DFB 0.8906
913 8IG 0.8905
914 1XM 0.8905
915 SYA 0.8903
916 SMV 0.8902
917 ALL 0.8901
918 CXH 0.8899
919 LKA 0.8899
920 6OT 0.8898
921 JZ5 0.8897
922 PPY 0.8897
923 FBT 0.8896
924 EMZ 0.8895
925 XYS 0.8895
926 PZM 0.8893
927 YIO 0.8892
928 MAN 0.8890
929 KTJ 0.8890
930 WOO 0.8889
931 SJ5 0.8889
932 2DR 0.8889
933 SEP 0.8888
934 SRO 0.8888
935 GWM 0.8887
936 2MH 0.8887
937 7MH 0.8886
938 PQK 0.8883
939 X05 0.8881
940 GBD 0.8880
941 RSF 0.8879
942 45C 0.8878
943 MO8 0.8876
944 6QF 0.8876
945 HHR 0.8876
946 DBJ 0.8876
947 OHG 0.8876
948 PRO 0.8874
949 TLA 0.8872
950 EN1 0.8871
951 F5B 0.8871
952 HX4 0.8870
953 2PG 0.8870
954 344 0.8869
955 JYB 0.8869
956 H33 0.8868
957 FUL 0.8867
958 JBQ 0.8866
959 ALE 0.8864
960 27B 0.8864
961 TZC 0.8864
962 5XB 0.8863
963 13P 0.8863
964 N91 0.8862
965 RUY 0.8862
966 PEL 0.8860
967 286 0.8860
968 3QV 0.8860
969 C2A 0.8860
970 H76 0.8860
971 BP9 0.8857
972 MZW 0.8857
973 35C 0.8857
974 DQA 0.8857
975 BOA 0.8856
976 EQT 0.8856
977 GIO 0.8856
978 PXM 0.8852
979 NVU 0.8851
980 1XA 0.8851
981 RIP 0.8851
982 DMJ 0.8850
983 DIE 0.8848
984 ASN 0.8847
985 RNS 0.8847
986 CLZ 0.8847
987 HSE 0.8847
988 2K8 0.8847
989 DA4 0.8846
990 4HP 0.8846
991 KMT 0.8846
992 BCP 0.8845
993 PHH 0.8845
994 PQ0 0.8845
995 RD4 0.8845
996 TP5 0.8844
997 IOS 0.8843
998 N7I 0.8843
999 HY3 0.8843
1000 1L5 0.8842
1001 FHC 0.8841
1002 BK9 0.8840
1003 HSO 0.8840
1004 30G 0.8840
1005 DHI 0.8839
1006 SKF 0.8839
1007 L3Q 0.8838
1008 XIZ 0.8838
1009 KGK 0.8835
1010 DFU 0.8833
1011 3VX 0.8832
1012 A09 0.8831
1013 1MR 0.8830
1014 0MK 0.8829
1015 IDH 0.8829
1016 2GS 0.8829
1017 KYD 0.8828
1018 GZ2 0.8828
1019 M6Z 0.8826
1020 1DV 0.8826
1021 3PG 0.8826
1022 R2P 0.8825
1023 1DU 0.8825
1024 SPV 0.8824
1025 HHS 0.8823
1026 AA 0.8822
1027 BML 0.8821
1028 ANF 0.8820
1029 WOT 0.8820
1030 MET 0.8820
1031 2KA 0.8819
1032 B60 0.8819
1033 RNO 0.8818
1034 R8A 0.8816
1035 6VD 0.8816
1036 UFO 0.8816
1037 L14 0.8815
1038 DX3 0.8815
1039 URQ 0.8814
1040 4NG 0.8813
1041 JBN 0.8812
1042 F1A 0.8811
1043 P7Y 0.8810
1044 1WC 0.8810
1045 4KL 0.8809
1046 9RW 0.8809
1047 B2J 0.8809
1048 1Z6 0.8808
1049 GLF 0.8807
1050 QBM 0.8807
1051 FUC 0.8807
1052 6LW 0.8806
1053 AHB 0.8806
1054 JFD 0.8805
1055 FF2 0.8804
1056 5VL 0.8804
1057 2FT 0.8803
1058 PCA 0.8803
1059 FOA 0.8801
1060 4LW 0.8801
1061 SXS 0.8800
1062 X0U 0.8799
1063 DS0 0.8797
1064 PH3 0.8797
1065 MAQ 0.8796
1066 TBP 0.8796
1067 NYL 0.8795
1068 DGN 0.8794
1069 OXZ 0.8793
1070 LSA 0.8793
1071 JXN 0.8793
1072 L7T 0.8792
1073 95Z 0.8792
1074 YPN 0.8790
1075 PEQ 0.8790
1076 B5D 0.8790
1077 MXN 0.8789
1078 JZ9 0.8788
1079 MAE 0.8788
1080 28N 0.8787
1081 LG4 0.8786
1082 OKG 0.8784
1083 NDM 0.8783
1084 PA1 0.8783
1085 ZB1 0.8783
1086 S0E 0.8781
1087 449 0.8781
1088 O2A 0.8780
1089 APS 0.8780
1090 47J 0.8777
1091 ROI 0.8777
1092 4HS 0.8777
1093 SIN 0.8777
1094 TSR 0.8776
1095 HCI 0.8776
1096 PYC 0.8775
1097 S24 0.8773
1098 4JU 0.8773
1099 AHN 0.8772
1100 SMN 0.8772
1101 SR1 0.8772
1102 2QC 0.8772
1103 2PC 0.8772
1104 R2B 0.8770
1105 PRY 0.8770
1106 MNM 0.8770
1107 K17 0.8770
1108 DNA 0.8767
1109 ARP 0.8767
1110 ANC 0.8765
1111 8XQ 0.8765
1112 12M 0.8765
1113 HKD 0.8764
1114 TAG 0.8763
1115 39A 0.8762
1116 RBJ 0.8761
1117 1QP 0.8760
1118 1X7 0.8760
1119 M6W 0.8760
1120 GLT 0.8759
1121 680 0.8759
1122 FUM 0.8759
1123 4CH 0.8758
1124 M2H 0.8757
1125 ALA ALA 0.8757
1126 61M 0.8757
1127 GNM 0.8756
1128 MNN 0.8756
1129 ARB 0.8756
1130 HDL 0.8755
1131 8U3 0.8755
1132 FRU 0.8755
1133 DEW 0.8753
1134 PMF 0.8753
1135 LR5 0.8752
1136 HHH 0.8751
1137 LAO 0.8750
1138 505 0.8750
1139 AH8 0.8750
1140 265 0.8750
1141 X09 0.8749
1142 YZM 0.8748
1143 TEO 0.8747
1144 BMA 0.8747
1145 6DP 0.8747
1146 XYL 0.8746
1147 948 0.8745
1148 KMH 0.8743
1149 7VJ 0.8743
1150 9YL 0.8743
1151 363 0.8741
1152 LEU 0.8739
1153 5WX 0.8739
1154 P9E 0.8738
1155 GHM 0.8737
1156 BSP 0.8736
1157 FBF 0.8735
1158 2BX 0.8734
1159 X0W 0.8733
1160 C9E 0.8733
1161 H5B 0.8732
1162 PXY 0.8732
1163 RBL 0.8731
1164 I6G 0.8731
1165 ADK 0.8731
1166 OW7 0.8730
1167 8K2 0.8728
1168 RNT 0.8725
1169 20J 0.8724
1170 FCB 0.8724
1171 G12 0.8723
1172 3HG 0.8723
1173 HG3 0.8722
1174 TZE 0.8720
1175 IFM 0.8720
1176 GGL 0.8720
1177 IP0 0.8719
1178 TBS 0.8718
1179 AZF 0.8717
1180 SG2 0.8715
1181 0TR 0.8715
1182 LYS 0.8715
1183 KFH 0.8714
1184 NLE 0.8710
1185 LRH 0.8710
1186 7B3 0.8709
1187 0GZ 0.8708
1188 V1T 0.8708
1189 CXP 0.8707
1190 4VY 0.8706
1191 SS2 0.8705
1192 HLD 0.8704
1193 0XT 0.8704
1194 F4K 0.8704
1195 HGQ 0.8704
1196 0LH 0.8703
1197 E35 0.8702
1198 5NE 0.8701
1199 YTX 0.8700
1200 D07 0.8699
1201 HNQ 0.8699
1202 Z6J 0.8698
1203 HEW 0.8698
1204 JUG 0.8697
1205 SD4 0.8696
1206 HQE 0.8696
1207 4I8 0.8695
1208 CK2 0.8694
1209 KIB 0.8692
1210 FCA 0.8692
1211 68A 0.8691
1212 GJS 0.8691
1213 PCR 0.8690
1214 G1O 0.8690
1215 ICF 0.8689
1216 X48 0.8688
1217 XUL 0.8688
1218 M3T 0.8686
1219 0V5 0.8684
1220 Q71 0.8684
1221 LZ2 0.8683
1222 TAR 0.8681
1223 B3R 0.8681
1224 URP 0.8681
1225 IOL 0.8680
1226 HQ9 0.8679
1227 T9G 0.8679
1228 BDF 0.8678
1229 CRS 0.8678
1230 PLQ 0.8678
1231 S7J 0.8676
1232 5NS 0.8675
1233 JF6 0.8673
1234 JU2 0.8667
1235 9AP 0.8662
1236 7D2 0.8662
1237 HA7 0.8662
1238 I4B 0.8660
1239 RCO 0.8660
1240 293 0.8656
1241 4JN 0.8656
1242 3R4 0.8655
1243 JZ4 0.8654
1244 AMG 0.8654
1245 K32 0.8651
1246 MFB 0.8650
1247 AMQ 0.8649
1248 3CH 0.8648
1249 9PY 0.8647
1250 SME 0.8646
1251 CEE 0.8646
1252 K6X 0.8643
1253 4NZ 0.8643
1254 091 0.8643
1255 BPU 0.8642
1256 2MN 0.8642
1257 FPN 0.8642
1258 4H2 0.8641
1259 X8D 0.8641
1260 P80 0.8641
1261 7CZ 0.8641
1262 MRZ 0.8640
1263 0OC 0.8640
1264 TYE 0.8639
1265 JP2 0.8639
1266 JAB 0.8639
1267 2D3 0.8639
1268 4A5 0.8637
1269 329 0.8636
1270 25R 0.8636
1271 LDR 0.8634
1272 S2P 0.8634
1273 OQC 0.8634
1274 ABE 0.8633
1275 5TY 0.8632
1276 ZWZ 0.8631
1277 THA 0.8631
1278 FUF 0.8629
1279 HXX 0.8628
1280 K22 0.8627
1281 DA1 0.8627
1282 J1Z 0.8627
1283 GBN 0.8627
1284 DPT 0.8625
1285 3BU 0.8623
1286 5CL 0.8620
1287 JRB 0.8619
1288 DPZ 0.8617
1289 MHK 0.8616
1290 URA 0.8615
1291 2AS 0.8614
1292 CIG 0.8613
1293 HHQ 0.8613
1294 PYJ 0.8613
1295 NGO 0.8612
1296 UEG 0.8612
1297 6BL 0.8608
1298 BVF 0.8607
1299 B40 0.8604
1300 BNT 0.8603
1301 RJY 0.8600
1302 PEZ 0.8598
1303 N0Z 0.8597
1304 LG5 0.8597
1305 DHC 0.8597
1306 LG3 0.8597
1307 7MK 0.8596
1308 CFA 0.8596
1309 EUE 0.8593
1310 BQ2 0.8592
1311 2TQ 0.8590
1312 DAS 0.8589
1313 F2W 0.8589
1314 CYT 0.8589
1315 AEG 0.8585
1316 PGH 0.8583
1317 APY 0.8580
1318 JZ1 0.8578
1319 7I2 0.8576
1320 AIN 0.8573
1321 XCG 0.8569
1322 SHI 0.8564
1323 23W 0.8564
1324 3AE 0.8561
1325 OA3 0.8560
1326 GOX 0.8559
1327 CKA 0.8556
1328 E4P 0.8555
1329 TMG 0.8550
1330 FA6 0.8550
1331 JR2 0.8549
1332 GP9 0.8544
1333 JF2 0.8543
1334 G3H 0.8530
1335 FHN 0.8526
1336 FBJ 0.8525
1337 KVP 0.8520
1338 RUU 0.8520
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 3PCJ; Ligand: INO; 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: 3pcj.bio1) has 26 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 3PCJ; Ligand: INO; 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: 3pcj.bio1) has 26 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 3; Query (leader) PDB : 3PCJ; Ligand: INO; 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: 3pcj.bio1) has 16 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 4; Query (leader) PDB : 3PCJ; Ligand: INO; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 4) in the query (biounit: 3pcj.bio1) has 16 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 5; Query (leader) PDB : 3PCJ; Ligand: INO; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 5) in the query (biounit: 3pcj.bio1) has 16 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 6; Query (leader) PDB : 3PCJ; Ligand: INO; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 6) in the query (biounit: 3pcj.bio1) has 16 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 7; Query (leader) PDB : 3PCJ; Ligand: INO; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 7) in the query (biounit: 3pcj.bio1) has 25 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 8; Query (leader) PDB : 3PCJ; Ligand: INO; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 8) in the query (biounit: 3pcj.bio1) has 25 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 9; Query (leader) PDB : 3PCJ; Ligand: INO; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 9) in the query (biounit: 3pcj.bio1) has 16 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 10; Query (leader) PDB : 3PCJ; Ligand: INO; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 10) in the query (biounit: 3pcj.bio1) has 16 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 11; Query (leader) PDB : 3PCJ; Ligand: INO; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 11) in the query (biounit: 3pcj.bio1) has 25 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 12; Query (leader) PDB : 3PCJ; Ligand: INO; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 12) in the query (biounit: 3pcj.bio1) has 25 residues
No: Leader PDB Ligand Sequence Similarity
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