Receptor
PDB id Resolution Class Description Source Keywords
3CPO 1.24 Å EC: 5.3.3.1 CRYSTAL STRUCTURE OF KETOSTEROID ISOMERASE D40N WITH BOUND 2 FLUOROPHENOL PSEUDOMONAS PUTIDA ENZYME ACTIVE SITE HYDROGEN BOND GEOMETRY ISOMERASE LIPMETABOLISM STEROID METABOLISM
Ref.: TESTING GEOMETRICAL DISCRIMINATION WITHIN AN ENZYME SITE: CONSTRAINED HYDROGEN BONDING IN THE KETOSTERO ISOMERASE OXYANION HOLE J.AM.CHEM.SOC. V. 130 13696 2008
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
FP2 A:132;
Valid;
none;
submit data
112.102 C6 H5 F O c1ccc...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
5AI1 2.1 Å EC: 5.3.3.1 CRYSTAL STRUCTURE OF KETOSTEROID ISOMERASE CONTAINING Y32F, D40N, Y57F AND Y119F MUTATIONS IN THE EQUILENIN-BOUND FORM PSEUDOMONAS PUTIDA ISOMERASE KETOSTEROID ISOMERASE PSEUDOMONAS PUTIDA EQUILE
Ref.: CONTRIBUTION OF A LOW-BARRIER HYDROGEN BOND TO CATA NOT SIGNIFICANT IN KETOSTEROID ISOMERASE. MOL.CELLS V. 38 409 2015
Members (26)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 3CPO - FP2 C6 H5 F O c1ccc(c(c1....
2 1W6Y Kd = 4.4 uM EQU C18 H18 O2 C[C@]12CCc....
3 5AI1 Kd = 0.34 uM EQU C18 H18 O2 C[C@]12CCc....
4 5G2G Kd = 0.9 uM EQU C18 H18 O2 C[C@]12CCc....
5 6C17 - DNX C6 H4 N2 O5 c1cc(c(cc1....
6 1GS3 - EQU C18 H18 O2 C[C@]12CCc....
7 5KP1 - EQU C18 H18 O2 C[C@]12CCc....
8 1OHO - EQU C18 H18 O2 C[C@]12CCc....
9 1CQS - EQU C18 H18 O2 C[C@]12CCc....
10 3OWY - EQU C18 H18 O2 C[C@]12CCc....
11 5KP4 - 6VW C18 H26 O2 C[C@]12CC[....
12 3IPT - EQU C18 H18 O2 C[C@]12CCc....
13 1OH0 - EQU C18 H18 O2 C[C@]12CCc....
14 1OGX Kd = 0.81 uM EQU C18 H18 O2 C[C@]12CCc....
15 1E3V Kd = 45.74 uM DXC C24 H40 O4 C[C@H](CCC....
16 6C1J - DNX C6 H4 N2 O5 c1cc(c(cc1....
17 6UFS - Q6J C18 H28 O2 C[C@]12CC[....
18 2PZV Kd = 135 uM IPH C6 H6 O c1ccc(cc1)....
19 3FZW - EQU C18 H18 O2 C[C@]12CCc....
20 6C1X - DNX C6 H4 N2 O5 c1cc(c(cc1....
21 3T8N - EDT C10 H16 N2 O8 C(CN(CC(=O....
22 1E3R - AND C19 H28 O2 C[C@]12CC[....
23 2INX - FFP C6 H4 F2 O c1cc(c(c(c....
24 3OWU - EQU C18 H18 O2 C[C@]12CCc....
25 5KP3 - EQU C18 H18 O2 C[C@]12CCc....
26 3OWS - EQU C18 H18 O2 C[C@]12CCc....
70% Homology Family (26)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 3CPO - FP2 C6 H5 F O c1ccc(c(c1....
2 1W6Y Kd = 4.4 uM EQU C18 H18 O2 C[C@]12CCc....
3 5AI1 Kd = 0.34 uM EQU C18 H18 O2 C[C@]12CCc....
4 5G2G Kd = 0.9 uM EQU C18 H18 O2 C[C@]12CCc....
5 6C17 - DNX C6 H4 N2 O5 c1cc(c(cc1....
6 1GS3 - EQU C18 H18 O2 C[C@]12CCc....
7 5KP1 - EQU C18 H18 O2 C[C@]12CCc....
8 1OHO - EQU C18 H18 O2 C[C@]12CCc....
9 1CQS - EQU C18 H18 O2 C[C@]12CCc....
10 3OWY - EQU C18 H18 O2 C[C@]12CCc....
11 5KP4 - 6VW C18 H26 O2 C[C@]12CC[....
12 3IPT - EQU C18 H18 O2 C[C@]12CCc....
13 1OH0 - EQU C18 H18 O2 C[C@]12CCc....
14 1OGX Kd = 0.81 uM EQU C18 H18 O2 C[C@]12CCc....
15 1E3V Kd = 45.74 uM DXC C24 H40 O4 C[C@H](CCC....
16 6C1J - DNX C6 H4 N2 O5 c1cc(c(cc1....
17 6UFS - Q6J C18 H28 O2 C[C@]12CC[....
18 2PZV Kd = 135 uM IPH C6 H6 O c1ccc(cc1)....
19 3FZW - EQU C18 H18 O2 C[C@]12CCc....
20 6C1X - DNX C6 H4 N2 O5 c1cc(c(cc1....
21 3T8N - EDT C10 H16 N2 O8 C(CN(CC(=O....
22 1E3R - AND C19 H28 O2 C[C@]12CC[....
23 2INX - FFP C6 H4 F2 O c1cc(c(c(c....
24 3OWU - EQU C18 H18 O2 C[C@]12CCc....
25 5KP3 - EQU C18 H18 O2 C[C@]12CCc....
26 3OWS - EQU C18 H18 O2 C[C@]12CCc....
50% Homology Family (31)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 3CPO - FP2 C6 H5 F O c1ccc(c(c1....
2 1W6Y Kd = 4.4 uM EQU C18 H18 O2 C[C@]12CCc....
3 5AI1 Kd = 0.34 uM EQU C18 H18 O2 C[C@]12CCc....
4 5G2G Kd = 0.9 uM EQU C18 H18 O2 C[C@]12CCc....
5 6C17 - DNX C6 H4 N2 O5 c1cc(c(cc1....
6 1GS3 - EQU C18 H18 O2 C[C@]12CCc....
7 5KP1 - EQU C18 H18 O2 C[C@]12CCc....
8 1OHO - EQU C18 H18 O2 C[C@]12CCc....
9 1CQS - EQU C18 H18 O2 C[C@]12CCc....
10 3OWY - EQU C18 H18 O2 C[C@]12CCc....
11 5KP4 - 6VW C18 H26 O2 C[C@]12CC[....
12 3IPT - EQU C18 H18 O2 C[C@]12CCc....
13 1OH0 - EQU C18 H18 O2 C[C@]12CCc....
14 1OGX Kd = 0.81 uM EQU C18 H18 O2 C[C@]12CCc....
15 1E3V Kd = 45.74 uM DXC C24 H40 O4 C[C@H](CCC....
16 6C1J - DNX C6 H4 N2 O5 c1cc(c(cc1....
17 6UFS - Q6J C18 H28 O2 C[C@]12CC[....
18 2PZV Kd = 135 uM IPH C6 H6 O c1ccc(cc1)....
19 3FZW - EQU C18 H18 O2 C[C@]12CCc....
20 6C1X - DNX C6 H4 N2 O5 c1cc(c(cc1....
21 3T8N - EDT C10 H16 N2 O8 C(CN(CC(=O....
22 1E3R - AND C19 H28 O2 C[C@]12CC[....
23 2INX - FFP C6 H4 F2 O c1cc(c(c(c....
24 3OWU - EQU C18 H18 O2 C[C@]12CCc....
25 5KP3 - EQU C18 H18 O2 C[C@]12CCc....
26 3OWS - EQU C18 H18 O2 C[C@]12CCc....
27 1OHS - 5SD C19 H28 O2 C[C@]12CCC....
28 5UGI - EQU C18 H18 O2 C[C@]12CCc....
29 1OHP - ESR C18 H26 O2 C[C@]12CC[....
30 1QJG - EQU C18 H18 O2 C[C@]12CCc....
31 1OGZ Kd = 1.4 uM EQU C18 H18 O2 C[C@]12CCc....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: FP2; Similar ligands found: 5
No: Ligand ECFP6 Tc MDL keys Tc
1 FP2 1 1
2 CAQ 0.5 0.619048
3 3FA 0.444444 0.809524
4 ZTN 0.444444 1
5 FFP 0.4 1
Similar Ligands (3D)
Ligand no: 1; Ligand: FP2; Similar ligands found: 670
No: Ligand Similarity coefficient
1 3ZQ 1.0255
2 40O 1.0000
3 OXE 1.0000
4 1AN 1.0000
5 JZ0 1.0000
6 2AF 1.0000
7 93Q 1.0000
8 92Z 1.0000
9 938 1.0000
10 L89 1.0000
11 76X 1.0000
12 2CH 1.0000
13 8LG 1.0000
14 HTS 0.9988
15 BEW 0.9941
16 YAN 0.9902
17 6X8 0.9849
18 MB3 0.9847
19 MMZ 0.9804
20 DTI 0.9793
21 KSW 0.9777
22 HSL 0.9766
23 0TR 0.9763
24 285 0.9728
25 XYP 0.9728
26 V1L 0.9698
27 URF 0.9695
28 7CZ 0.9691
29 DMI 0.9689
30 WBU 0.9683
31 TDR 0.9664
32 3MC 0.9662
33 1PT 0.9661
34 5UC 0.9655
35 4XX 0.9653
36 CYT 0.9653
37 MWM 0.9652
38 JZ3 0.9651
39 4AX 0.9650
40 4ZE 0.9649
41 RSF 0.9647
42 284 0.9643
43 ICP 0.9642
44 PYD 0.9642
45 MCT 0.9641
46 H3M 0.9640
47 NK 0.9634
48 1MC 0.9634
49 DUC 0.9631
50 CRS 0.9627
51 A2Q 0.9623
52 RCO 0.9622
53 URA 0.9621
54 LG3 0.9616
55 280 0.9615
56 IPH 0.9610
57 26D 0.9610
58 A1U 0.9609
59 TMZ 0.9607
60 QOS 0.9599
61 XYD 0.9598
62 CXL 0.9598
63 MBN 0.9597
64 XBZ 0.9590
65 HVK 0.9588
66 TMT 0.9588
67 2MP 0.9588
68 2AP 0.9588
69 9PO 0.9587
70 FLM 0.9586
71 3CH 0.9583
72 TH0 0.9581
73 34A 0.9578
74 4HO 0.9575
75 LGA 0.9572
76 2AC 0.9571
77 8GF 0.9568
78 HRZ 0.9564
79 PYG 0.9564
80 GMN 0.9564
81 TM7 0.9560
82 LG5 0.9558
83 ECE 0.9558
84 CYH 0.9557
85 WOT 0.9554
86 4CL 0.9553
87 MBD 0.9552
88 43M 0.9550
89 3AP 0.9549
90 MWJ 0.9548
91 27Y 0.9547
92 5MH 0.9547
93 4AP 0.9545
94 0R0 0.9543
95 BVF 0.9540
96 4JJ 0.9538
97 DXX 0.9537
98 XYS 0.9536
99 4JO 0.9532
100 2C9 0.9532
101 2YU 0.9522
102 JZ2 0.9520
103 MZG 0.9519
104 JZ1 0.9519
105 BR9 0.9515
106 HPY 0.9512
107 286 0.9512
108 J1Z 0.9507
109 3CE 0.9506
110 HT4 0.9504
111 AHR 0.9504
112 2MY 0.9503
113 R8A 0.9501
114 LXC 0.9500
115 2IM 0.9498
116 TM4 0.9495
117 0CT 0.9492
118 8CL 0.9491
119 7EX 0.9488
120 NEQ 0.9487
121 GXE 0.9484
122 1XX 0.9483
123 5JC 0.9481
124 CIG 0.9476
125 2CM 0.9475
126 DEN 0.9475
127 FPY 0.9474
128 6MH 0.9474
129 GVH 0.9469
130 HGQ 0.9469
131 3MH 0.9460
132 BZF 0.9460
133 HAI 0.9451
134 IUR 0.9449
135 IND 0.9438
136 BZI 0.9434
137 TTO 0.9433
138 DUB 0.9432
139 HEW 0.9429
140 64K 0.9427
141 TLD 0.9422
142 0R1 0.9422
143 L60 0.9420
144 M3T 0.9419
145 ICC 0.9416
146 IDH 0.9415
147 PLQ 0.9415
148 B3R 0.9414
149 4JP 0.9413
150 Y8I 0.9408
151 CEJ 0.9407
152 4H2 0.9393
153 MPI 0.9393
154 YHO 0.9389
155 LZ1 0.9389
156 IDM 0.9381
157 HIU 0.9381
158 ARA 0.9380
159 0MK 0.9379
160 24T 0.9378
161 HQE 0.9375
162 RIP 0.9371
163 275 0.9370
164 HHN 0.9368
165 DSN 0.9368
166 LG4 0.9364
167 ADE 0.9363
168 YTB 0.9362
169 HYN 0.9362
170 FPN 0.9358
171 F05 0.9358
172 HHQ 0.9357
173 DA1 0.9356
174 HPA 0.9355
175 PCR 0.9352
176 25R 0.9352
177 4DX 0.9349
178 9HX 0.9342
179 93B 0.9340
180 6MP 0.9333
181 7WA 0.9330
182 9DA 0.9328
183 E60 0.9326
184 PIH 0.9326
185 1WG 0.9325
186 BTE 0.9325
187 2MH 0.9324
188 2KT 0.9322
189 9EW 0.9320
190 150 0.9314
191 XIX 0.9313
192 PXY 0.9312
193 7HP 0.9311
194 FOA 0.9310
195 DGY 0.9310
196 KG7 0.9310
197 SVN 0.9310
198 BP1 0.9308
199 HLR 0.9308
200 OXM 0.9306
201 4CH 0.9305
202 OXQ 0.9301
203 FUC 0.9297
204 OXL 0.9295
205 45C 0.9293
206 HGW 0.9293
207 GBD 0.9293
208 WDL 0.9291
209 6UA 0.9291
210 ES4 0.9290
211 DMG 0.9288
212 PM6 0.9288
213 PYR 0.9285
214 4HS 0.9280
215 13X 0.9274
216 10L 0.9273
217 2OP 0.9267
218 MAK 0.9267
219 ARB 0.9266
220 AX2 0.9262
221 OXD 0.9262
222 JZ9 0.9260
223 NIS 0.9257
224 2CQ 0.9253
225 24B 0.9252
226 278 0.9250
227 3AY 0.9249
228 HGY 0.9243
229 4JN 0.9241
230 23A 0.9240
231 PYC 0.9240
232 F4Z 0.9237
233 282 0.9236
234 DAB 0.9232
235 MLT 0.9231
236 25W 0.9231
237 5ZE 0.9230
238 BML 0.9226
239 94N 0.9222
240 3Z7 0.9220
241 LAC 0.9220
242 L3Q 0.9218
243 HY3 0.9216
244 SWD 0.9216
245 DAL 0.9215
246 SER 0.9213
247 SYN 0.9213
248 0RW 0.9210
249 FPI 0.9209
250 265 0.9209
251 BNZ 0.9208
252 PRO 0.9203
253 25T 0.9202
254 BR8 0.9202
255 2ZX 0.9200
256 0PY 0.9199
257 FUL 0.9198
258 TC7 0.9196
259 KIV 0.9195
260 IOL 0.9195
261 GAG 0.9194
262 6HQ 0.9194
263 G6D 0.9194
264 B20 0.9193
265 4JU 0.9192
266 SEJ 0.9189
267 MZ0 0.9189
268 FYU 0.9188
269 260 0.9187
270 1AC 0.9187
271 SAL 0.9186
272 ALA 0.9184
273 DFU 0.9181
274 2DR 0.9179
275 5AC 0.9178
276 PHZ 0.9172
277 MLA 0.9172
278 6M4 0.9172
279 AMT 0.9158
280 PYF 0.9157
281 MLI 0.9156
282 XXR 0.9152
283 ABE 0.9150
284 ZZT 0.9149
285 2RA 0.9146
286 47J 0.9144
287 YCP 0.9144
288 HBX 0.9142
289 HMH 0.9139
290 JIF 0.9133
291 ERH 0.9128
292 C5J 0.9128
293 3PY 0.9127
294 ALO 0.9127
295 1DH 0.9124
296 3TR 0.9121
297 GOL 0.9121
298 1MR 0.9120
299 M2H 0.9119
300 NBE 0.9119
301 2PC 0.9118
302 BAQ 0.9117
303 BEZ 0.9112
304 NBZ 0.9110
305 P1R 0.9106
306 DBB 0.9105
307 A3B 0.9105
308 CYS 0.9101
309 PYM 0.9100
310 DFB 0.9099
311 ABN 0.9099
312 3U4 0.9098
313 35C 0.9098
314 BEN 0.9095
315 4ZC 0.9094
316 RP7 0.9093
317 JAB 0.9092
318 TP5 0.9091
319 FCA 0.9090
320 JBE 0.9089
321 T6C 0.9086
322 NSP 0.9086
323 MLM 0.9080
324 PY7 0.9080
325 APY 0.9078
326 NAK 0.9077
327 3SK 0.9077
328 6AI 0.9077
329 BUO 0.9076
330 NPY 0.9076
331 1WD 0.9075
332 HMU 0.9075
333 8H8 0.9075
334 BE2 0.9074
335 4SV 0.9074
336 6PC 0.9071
337 3MT 0.9071
338 3XX 0.9070
339 TZC 0.9069
340 QUZ 0.9068
341 5Y9 0.9066
342 1DW 0.9061
343 6M9 0.9060
344 VAL 0.9059
345 FUF 0.9056
346 BAM 0.9053
347 1CB 0.9053
348 5AN 0.9053
349 BZX 0.9053
350 JFD 0.9053
351 HUI 0.9052
352 9TY 0.9050
353 OXZ 0.9050
354 1XN 0.9048
355 JBN 0.9046
356 NCA 0.9046
357 ES6 0.9044
358 F5B 0.9041
359 HOW 0.9040
360 AZF 0.9040
361 VNJ 0.9040
362 PYJ 0.9040
363 273 0.9038
364 23W 0.9035
365 GBL 0.9035
366 2MZ 0.9032
367 ATQ 0.9030
368 IFM 0.9030
369 1AB 0.9030
370 7MH 0.9029
371 2AI 0.9025
372 MZY 0.9024
373 RIB 0.9023
374 ABA 0.9020
375 9CL 0.9019
376 1MZ 0.9017
377 60P 0.9016
378 MR3 0.9015
379 12M 0.9015
380 CIZ 0.9013
381 DTL 0.9012
382 JKE 0.9012
383 ALQ 0.9011
384 RAM 0.9006
385 ADZ 0.9004
386 IP0 0.9000
387 FPK 0.8998
388 GOO 0.8995
389 ES9 0.8988
390 5KX 0.8986
391 5MB 0.8986
392 F81 0.8986
393 NVI 0.8984
394 4MZ 0.8981
395 LER 0.8978
396 7WV 0.8976
397 AMC 0.8973
398 THR 0.8970
399 SMV 0.8968
400 5H1 0.8967
401 03W 0.8966
402 TH7 0.8962
403 EXO 0.8962
404 ADK 0.8961
405 PAF 0.8960
406 ASP 0.8960
407 5MP 0.8957
408 GUN 0.8955
409 AZA 0.8953
410 NIO 0.8951
411 2CK 0.8950
412 B24 0.8950
413 3ZS 0.8948
414 IT2 0.8948
415 DCY 0.8945
416 9DG 0.8945
417 3MA 0.8942
418 TAR 0.8942
419 XAN 0.8941
420 KYD 0.8940
421 6AP 0.8940
422 5Q0 0.8940
423 A2F 0.8939
424 DCD 0.8937
425 JZ6 0.8936
426 4XR 0.8936
427 F60 0.8935
428 HQY 0.8931
429 EDG 0.8930
430 FLA 0.8928
431 G3F 0.8926
432 LMR 0.8926
433 14O 0.8926
434 5MI 0.8925
435 R2B 0.8924
436 O72 0.8922
437 TCZ 0.8922
438 11S 0.8922
439 BVC 0.8918
440 IGA 0.8916
441 1DU 0.8916
442 FK1 0.8915
443 H4N 0.8914
444 2XX 0.8914
445 1NP 0.8913
446 8NY 0.8912
447 7B4 0.8912
448 5SG 0.8911
449 5IQ 0.8911
450 2K4 0.8911
451 290 0.8909
452 PZA 0.8907
453 261 0.8901
454 O7U 0.8900
455 TBP 0.8900
456 C2A 0.8900
457 GLC 0.8900
458 4YS 0.8899
459 CRN 0.8899
460 ES1 0.8898
461 Z6J 0.8898
462 JPZ 0.8898
463 N5J 0.8898
464 6GU 0.8896
465 1LM 0.8895
466 TFB 0.8894
467 CFP 0.8893
468 YH7 0.8892
469 2ZV 0.8889
470 1SQ 0.8888
471 AZG 0.8888
472 AKB 0.8886
473 1LQ 0.8886
474 DPR 0.8881
475 P3K 0.8880
476 JBH 0.8878
477 192 0.8876
478 BOA 0.8876
479 PRS 0.8876
480 24W 0.8874
481 82I 0.8873
482 270 0.8873
483 TF4 0.8872
484 6F0 0.8872
485 DX4 0.8871
486 VGL 0.8870
487 SS1 0.8870
488 1XM 0.8869
489 ITN 0.8868
490 QSC 0.8866
491 GRE 0.8864
492 NTN 0.8863
493 FP1 0.8860
494 KPL 0.8860
495 EQT 0.8859
496 C21 0.8852
497 7HQ 0.8851
498 ES3 0.8850
499 141 0.8849
500 HH8 0.8849
501 UNU 0.8846
502 GIO 0.8845
503 4PW 0.8845
504 M1A 0.8843
505 RM4 0.8842
506 H76 0.8840
507 HBA 0.8840
508 BYZ 0.8837
509 6M1 0.8836
510 ISN 0.8832
511 BVG 0.8831
512 7W4 0.8829
513 4XH 0.8828
514 RNS 0.8826
515 1LN 0.8826
516 KOJ 0.8823
517 3DO 0.8823
518 MRY 0.8817
519 AX7 0.8813
520 BGC 0.8811
521 6SP 0.8810
522 MSN 0.8810
523 NOJ 0.8809
524 HH5 0.8808
525 P2D 0.8807
526 KKN 0.8806
527 URQ 0.8803
528 MZW 0.8801
529 0CU 0.8799
530 BCP 0.8796
531 JAE 0.8796
532 B53 0.8794
533 I3A 0.8793
534 P92 0.8792
535 FCB 0.8792
536 BHO 0.8791
537 M58 0.8789
538 PBC 0.8784
539 BAE 0.8781
540 G2F 0.8780
541 HBS 0.8780
542 S76 0.8779
543 2LP 0.8776
544 HVQ 0.8773
545 XM0 0.8772
546 2A7 0.8771
547 HLT 0.8769
548 OHG 0.8767
549 JZ4 0.8766
550 TLA 0.8766
551 BAL 0.8766
552 AAE 0.8762
553 9X7 0.8760
554 2MI 0.8759
555 MFB 0.8758
556 FUB 0.8758
557 HIO 0.8756
558 JBK 0.8754
559 ES7 0.8754
560 3RK 0.8754
561 8GC 0.8753
562 TAY 0.8752
563 ASO 0.8750
564 ASN 0.8749
565 PCA 0.8748
566 5RG 0.8747
567 67N 0.8747
568 5NU 0.8746
569 3OH 0.8744
570 ABV 0.8741
571 IFL 0.8740
572 PYZ 0.8740
573 AC0 0.8737
574 Q88 0.8733
575 OAA 0.8732
576 FBA 0.8730
577 PAV 0.8730
578 BSX 0.8730
579 LDU 0.8729
580 6CS 0.8729
581 5WV 0.8725
582 CWM 0.8721
583 NOY 0.8720
584 DBH 0.8719
585 XQG 0.8719
586 3M0 0.8719
587 HX3 0.8719
588 INS 0.8718
589 ES0 0.8716
590 5MK 0.8710
591 AGK 0.8710
592 4VP 0.8710
593 BDR 0.8709
594 R8S 0.8707
595 3HA 0.8707
596 HSE 0.8706
597 AUD 0.8705
598 3F0 0.8702
599 PRY 0.8700
600 4JL 0.8698
601 SX1 0.8697
602 32O 0.8697
603 CP 0.8694
604 54G 0.8692
605 GTQ 0.8692
606 HHA 0.8692
607 M1E 0.8690
608 51F 0.8690
609 XQ0 0.8689
610 5M0 0.8685
611 LZM 0.8684
612 H8N 0.8682
613 RM1 0.8682
614 LCN 0.8680
615 GIF 0.8680
616 42A 0.8678
617 1P7 0.8677
618 PBE 0.8673
619 9TZ 0.8669
620 RUU 0.8668
621 URP 0.8665
622 MAN 0.8660
623 PHB 0.8660
624 5B1 0.8657
625 MNM 0.8657
626 3NT 0.8656
627 4JM 0.8655
628 MAE 0.8653
629 6KX 0.8648
630 5CU 0.8647
631 G5V 0.8644
632 14J 0.8643
633 DMJ 0.8640
634 5HN 0.8638
635 DTU 0.8630
636 2EZ 0.8630
637 ZZ3 0.8627
638 DMD 0.8627
639 C2B 0.8625
640 DOB 0.8624
641 9MG 0.8621
642 4M0 0.8617
643 FA0 0.8614
644 3AB 0.8614
645 NCM 0.8613
646 HFB 0.8612
647 BP9 0.8611
648 3DM 0.8609
649 3WA 0.8599
650 F0J 0.8593
651 3HB 0.8593
652 GAB 0.8591
653 39A 0.8591
654 ARW 0.8590
655 3ID 0.8587
656 PRI 0.8581
657 LRH 0.8570
658 SS2 0.8570
659 TZE 0.8570
660 98J 0.8568
661 5WX 0.8552
662 T2C 0.8548
663 NMJ 0.8546
664 KJY 0.8542
665 03V 0.8537
666 JBQ 0.8533
667 COU 0.8528
668 MMU 0.8526
669 V55 0.8525
670 PXL 0.8521
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 5AI1; Ligand: EQU; 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: 5ai1.bio1) has 18 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 5AI1; Ligand: EQU; 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: 5ai1.bio1) has 18 residues
No: Leader PDB Ligand Sequence Similarity
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