Receptor
PDB id Resolution Class Description Source Keywords
1B3V 2.4 Å EC: 3.2.1.8 XYLANASE FROM PENICILLIUM SIMPLICISSIMUM, COMPLEX WITH XYLOS PENICILLIUM SIMPLICISSIMUM FAMILY 10 XYLANASE PENICILLIUM SIMPLICISSIMUM GLYCOSYL HYDSUBSTRATE BINDING
Ref.: XYLAN BINDING SUBSITE MAPPING IN THE XYLANASE FROM PENICILLIUM SIMPLICISSIMUM USING XYLOOLIGOSACCHARID CRYO-PROTECTANT. BIOCHEMISTRY V. 38 2403 1999
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
XYP A:523;
A:524;
A:526;
Valid;
Valid;
Invalid;
none;
none;
none;
submit data
150.13 C5 H10 O5 C1[C@...
XYS A:525;
Valid;
none;
submit data
150.13 C5 H10 O5 C1[C@...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1B3X 2.2 Å EC: 3.2.1.8 XYLANASE FROM PENICILLIUM SIMPLICISSIMUM, COMPLEX WITH XYLOT PENICILLIUM SIMPLICISSIMUM FAMILY 10 XYLANASE PENICILLIUM SIMPLICISSIMUM GLYCOSYL HYDSUBSTRATE BINDING
Ref.: XYLAN BINDING SUBSITE MAPPING IN THE XYLANASE FROM PENICILLIUM SIMPLICISSIMUM USING XYLOOLIGOSACCHARID CRYO-PROTECTANT. BIOCHEMISTRY V. 38 2403 1999
Members (5)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 34 families.
1 1B30 - XYP XYP XYP n/a n/a
2 1B3V - XYS C5 H10 O5 C1[C@H]([C....
3 1B3Y - XYS C5 H10 O5 C1[C@H]([C....
4 1B3X - XYP XYP XYP n/a n/a
5 1B3Z - XYP XYP XYP n/a n/a
70% Homology Family (20)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 32 families.
1 1B30 - XYP XYP XYP n/a n/a
2 1B3V - XYS C5 H10 O5 C1[C@H]([C....
3 1B3Y - XYS C5 H10 O5 C1[C@H]([C....
4 1B3X - XYP XYP XYP n/a n/a
5 1B3Z - XYP XYP XYP n/a n/a
6 2BNJ - XYP XYP AHR FER n/a n/a
7 7K4X Kd = 13.04 uM 6NT C6 H4 N4 O2 c1cc2c(cc1....
8 5RGA - 6NT C6 H4 N4 O2 c1cc2c(cc1....
9 7K4Z - 6NT C6 H4 N4 O2 c1cc2c(cc1....
10 1GOR - XYS XYP n/a n/a
11 7K4Q Kd = 372.5 uM 6NT C6 H4 N4 O2 c1cc2c(cc1....
12 5RGD - 6NT C6 H4 N4 O2 c1cc2c(cc1....
13 7K4U - 6NT C6 H4 N4 O2 c1cc2c(cc1....
14 5RGC - 6NT C6 H4 N4 O2 c1cc2c(cc1....
15 4BS0 Ki = 2 uM 6NT C6 H4 N4 O2 c1cc2c(cc1....
16 3NYD - 3NY C6 H4 N4 O2 c1cc2c(cc1....
17 5RGB - 6NT C6 H4 N4 O2 c1cc2c(cc1....
18 5RGE - 6NT C6 H4 N4 O2 c1cc2c(cc1....
19 1GOQ - XYP XYP n/a n/a
20 5RGF - 6NT C6 H4 N4 O2 c1cc2c(cc1....
50% Homology Family (63)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 19 families.
1 1V0M - XDN XYP n/a n/a
2 1V0N - XIF XYP n/a n/a
3 1V0K Ki = 40 uM XYP XDN n/a n/a
4 1V0L Ki = 480 nM XIF XYP n/a n/a
5 1OD8 - XDL XYP n/a n/a
6 3W25 - XYP XYP n/a n/a
7 3W27 - XYS XYP n/a n/a
8 3W26 - XYP XYP XYP n/a n/a
9 3W29 - XYS XYP XYP XYP n/a n/a
10 3W28 - XYS XYP XYP n/a n/a
11 1B30 - XYP XYP XYP n/a n/a
12 1B3V - XYS C5 H10 O5 C1[C@H]([C....
13 1B3Y - XYS C5 H10 O5 C1[C@H]([C....
14 1B3X - XYP XYP XYP n/a n/a
15 1B3Z - XYP XYP XYP n/a n/a
16 1ISY - BGC C6 H12 O6 C([C@@H]1[....
17 1V6W - XYP XYP n/a n/a
18 1ISX - XYP XYP n/a n/a
19 1ISZ - GAL C6 H12 O6 C([C@@H]1[....
20 1V6U - XYP XYP n/a n/a
21 1V6X - XYP XYP n/a n/a
22 1V6V - XYP XYP n/a n/a
23 2D24 - XYS XYS n/a n/a
24 2D23 - XYS AZI XYS n/a n/a
25 1IT0 - BGC GAL n/a n/a
26 1ISW - XYP XYP n/a n/a
27 2D20 - NPO C6 H5 N O3 c1cc(ccc1[....
28 1ISV - XYP C5 H10 O5 C1[C@H]([C....
29 3EMZ - HXH C19 H21 N O4 c1ccc(cc1)....
30 3WUE - XYP C5 H10 O5 C1[C@H]([C....
31 3WUG - XYP C5 H10 O5 C1[C@H]([C....
32 1FH7 Ki = 5.8 uM XYP XDN n/a n/a
33 1FHD Ki = 0.15 uM XYP XIM n/a n/a
34 1FH8 Ki = 0.13 uM XYP XIF n/a n/a
35 1J01 Ki = 0.34 uM XIL C10 H17 N O7 C1CNC(=O)[....
36 1FH9 Ki = 0.37 uM LOX XYP n/a n/a
37 5D4Y - XYP XYP n/a n/a
38 2FGL - XYS XYS n/a n/a
39 3NJ3 - XYP XYP n/a n/a
40 1VBR - XYP XYS n/a n/a
41 2BNJ - XYP XYP AHR FER n/a n/a
42 7K4X Kd = 13.04 uM 6NT C6 H4 N4 O2 c1cc2c(cc1....
43 5RGA - 6NT C6 H4 N4 O2 c1cc2c(cc1....
44 7K4Z - 6NT C6 H4 N4 O2 c1cc2c(cc1....
45 1GOR - XYS XYP n/a n/a
46 7K4Q Kd = 372.5 uM 6NT C6 H4 N4 O2 c1cc2c(cc1....
47 5RGD - 6NT C6 H4 N4 O2 c1cc2c(cc1....
48 7K4U - 6NT C6 H4 N4 O2 c1cc2c(cc1....
49 5RGC - 6NT C6 H4 N4 O2 c1cc2c(cc1....
50 4BS0 Ki = 2 uM 6NT C6 H4 N4 O2 c1cc2c(cc1....
51 3NYD - 3NY C6 H4 N4 O2 c1cc2c(cc1....
52 5RGB - 6NT C6 H4 N4 O2 c1cc2c(cc1....
53 5RGE - 6NT C6 H4 N4 O2 c1cc2c(cc1....
54 1GOQ - XYP XYP n/a n/a
55 5RGF - 6NT C6 H4 N4 O2 c1cc2c(cc1....
56 1UQY - XYP XYP XYP XYP n/a n/a
57 1UR1 - XYS XYP AHR n/a n/a
58 1UQZ - XYP XYP XYP GCV n/a n/a
59 3RDK - XYS XYP XYP GCV n/a n/a
60 5OFK - XYP XYP XYP XYP XYP XYP XYP n/a n/a
61 5OFL Ka = 17500 M^-1 BGC BGC BGC BGC BGC BGC n/a n/a
62 1R87 - XYP XYP n/a n/a
63 1HIZ - GLC C6 H12 O6 C([C@@H]1[....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: XYP; Similar ligands found: 10
No: Ligand ECFP6 Tc MDL keys Tc
1 64K 1 1
2 RIP 1 1
3 HSY 1 1
4 XYS 1 1
5 LXC 1 1
6 0MK 1 1
7 XYP 1 1
8 SEJ 1 1
9 ARA 1 1
10 ARB 1 1
Ligand no: 2; Ligand: XYS; Similar ligands found: 10
No: Ligand ECFP6 Tc MDL keys Tc
1 64K 1 1
2 RIP 1 1
3 HSY 1 1
4 XYS 1 1
5 LXC 1 1
6 0MK 1 1
7 XYP 1 1
8 SEJ 1 1
9 ARA 1 1
10 ARB 1 1
Similar Ligands (3D)
Ligand no: 1; Ligand: XYP; Similar ligands found: 1177
No: Ligand Similarity coefficient
1 PYG 1.0319
2 FLM 1.0000
3 3MC 1.0000
4 FFP 1.0000
5 RAM 1.0000
6 GLC 1.0000
7 MBD 0.9993
8 XBZ 0.9992
9 URF 0.9982
10 GMN 0.9972
11 3CE 0.9971
12 0TR 0.9968
13 3FA 0.9968
14 23A 0.9964
15 2C9 0.9961
16 WBU 0.9955
17 2MY 0.9952
18 TDR 0.9949
19 TM4 0.9949
20 SWD 0.9940
21 6MH 0.9940
22 4HO 0.9936
23 DUB 0.9936
24 ICP 0.9935
25 BTE 0.9930
26 MCT 0.9920
27 URA 0.9917
28 1MC 0.9913
29 2CM 0.9909
30 MWM 0.9909
31 PYD 0.9907
32 7CZ 0.9906
33 XYD 0.9904
34 ADE 0.9901
35 FCA 0.9898
36 34A 0.9898
37 2AC 0.9898
38 2MP 0.9896
39 275 0.9896
40 82I 0.9893
41 TH0 0.9889
42 4ZE 0.9888
43 5UC 0.9887
44 JZ2 0.9887
45 A1U 0.9886
46 NK 0.9885
47 5MH 0.9882
48 4JJ 0.9873
49 AHR 0.9870
50 HPA 0.9868
51 4CL 0.9867
52 26D 0.9866
53 43M 0.9864
54 M1A 0.9856
55 CRS 0.9851
56 3MH 0.9850
57 QOS 0.9849
58 CAQ 0.9847
59 P3K 0.9846
60 7HP 0.9845
61 9DA 0.9838
62 4JO 0.9833
63 7WA 0.9830
64 ADK 0.9830
65 BP1 0.9828
66 67N 0.9828
67 6MP 0.9823
68 TM7 0.9823
69 2YU 0.9823
70 27Y 0.9823
71 BR9 0.9818
72 MZG 0.9817
73 5Q0 0.9813
74 EXO 0.9813
75 3XX 0.9810
76 3MA 0.9806
77 9HX 0.9805
78 MWJ 0.9801
79 94N 0.9800
80 HT4 0.9798
81 10L 0.9797
82 1NP 0.9795
83 O72 0.9793
84 NOJ 0.9791
85 5SG 0.9789
86 39A 0.9788
87 HQY 0.9783
88 3WA 0.9782
89 JZ3 0.9782
90 HFB 0.9781
91 EQT 0.9780
92 5JC 0.9780
93 F81 0.9780
94 ADZ 0.9775
95 ES1 0.9772
96 NPY 0.9767
97 IUR 0.9766
98 QUZ 0.9764
99 4YS 0.9764
100 JBQ 0.9764
101 FUC 0.9762
102 7B4 0.9761
103 7W4 0.9760
104 6AI 0.9760
105 KKN 0.9759
106 1LQ 0.9759
107 DFU 0.9758
108 F05 0.9757
109 KJY 0.9756
110 FYU 0.9756
111 2CH 0.9755
112 6UA 0.9755
113 CYT 0.9754
114 93Q 0.9754
115 1SQ 0.9752
116 0R0 0.9752
117 HGQ 0.9749
118 BZX 0.9747
119 8H8 0.9747
120 ISN 0.9746
121 JPZ 0.9746
122 5IQ 0.9745
123 1LM 0.9743
124 RCO 0.9743
125 0CT 0.9741
126 PM6 0.9741
127 92Z 0.9741
128 76X 0.9739
129 SAL 0.9738
130 OXE 0.9737
131 TLD 0.9735
132 IND 0.9734
133 JZ0 0.9732
134 HTS 0.9732
135 HMH 0.9730
136 8LG 0.9729
137 FP2 0.9728
138 G6D 0.9727
139 JIF 0.9727
140 FUL 0.9726
141 5WV 0.9724
142 2AF 0.9724
143 JBH 0.9723
144 ES7 0.9721
145 ES4 0.9720
146 N5J 0.9719
147 BEW 0.9719
148 LG3 0.9719
149 3CH 0.9717
150 1AN 0.9715
151 GVH 0.9713
152 DFB 0.9711
153 TMT 0.9710
154 F5B 0.9709
155 6F0 0.9709
156 BVF 0.9707
157 8GF 0.9706
158 BZF 0.9701
159 BZI 0.9699
160 PLQ 0.9698
161 B53 0.9698
162 938 0.9697
163 L89 0.9697
164 4JP 0.9695
165 BCF 0.9692
166 LG5 0.9691
167 NOY 0.9690
168 ASO 0.9690
169 JFD 0.9689
170 MPI 0.9688
171 0R1 0.9686
172 9EW 0.9686
173 1DW 0.9686
174 DEN 0.9684
175 SVN 0.9683
176 IFM 0.9682
177 14O 0.9679
178 25W 0.9679
179 1WG 0.9678
180 IDM 0.9674
181 TMZ 0.9671
182 Y8I 0.9671
183 G5V 0.9671
184 GRE 0.9669
185 5MB 0.9667
186 6X8 0.9665
187 3RK 0.9663
188 BBF 0.9662
189 YTB 0.9661
190 3DM 0.9660
191 IFL 0.9660
192 T6C 0.9659
193 HLR 0.9657
194 A2F 0.9656
195 FPN 0.9656
196 PXL 0.9655
197 24W 0.9654
198 GBD 0.9654
199 CIG 0.9654
200 FPY 0.9653
201 AZA 0.9652
202 IGA 0.9652
203 2ZV 0.9650
204 5H1 0.9650
205 GUN 0.9650
206 AZG 0.9650
207 LCN 0.9650
208 PCI 0.9650
209 5M0 0.9648
210 7MH 0.9647
211 LZ1 0.9645
212 UEG 0.9642
213 G2F 0.9642
214 F60 0.9641
215 BE2 0.9639
216 2K4 0.9638
217 3U4 0.9636
218 INS 0.9635
219 ZZT 0.9634
220 XXR 0.9634
221 5MI 0.9631
222 HH8 0.9631
223 KYD 0.9630
224 6HQ 0.9627
225 1XX 0.9627
226 PXM 0.9626
227 ARW 0.9626
228 0RW 0.9625
229 13X 0.9625
230 141 0.9624
231 XAN 0.9623
232 JBE 0.9622
233 OXQ 0.9622
234 9DG 0.9620
235 35C 0.9619
236 ES9 0.9618
237 6AP 0.9618
238 4XH 0.9617
239 290 0.9617
240 F3B 0.9617
241 YH7 0.9616
242 4ZC 0.9616
243 4H2 0.9613
244 MAK 0.9612
245 2CK 0.9611
246 YAN 0.9611
247 60P 0.9610
248 HMU 0.9609
249 HQE 0.9609
250 IBF 0.9607
251 4SV 0.9606
252 BR8 0.9606
253 24B 0.9605
254 RIB 0.9604
255 ES6 0.9602
256 8S0 0.9601
257 B3R 0.9601
258 5CL 0.9601
259 3M0 0.9600
260 HEW 0.9595
261 5RG 0.9593
262 H4N 0.9592
263 3AY 0.9592
264 DQN 0.9591
265 GAG 0.9587
266 NSP 0.9587
267 PCR 0.9587
268 M3T 0.9587
269 DBH 0.9586
270 IDH 0.9586
271 GTQ 0.9582
272 DA1 0.9582
273 OXZ 0.9578
274 11S 0.9577
275 BGC 0.9576
276 6GU 0.9573
277 3HA 0.9572
278 JKE 0.9571
279 PXY 0.9571
280 2XX 0.9571
281 6LW 0.9569
282 DX4 0.9568
283 Q88 0.9568
284 3F0 0.9567
285 6M9 0.9566
286 1WD 0.9566
287 AX2 0.9564
288 BOA 0.9563
289 M1E 0.9561
290 XQ0 0.9560
291 TAR 0.9559
292 54G 0.9558
293 7HQ 0.9557
294 12Q 0.9556
295 JZ9 0.9555
296 HHQ 0.9553
297 5ZE 0.9551
298 FCB 0.9550
299 GOO 0.9550
300 FK1 0.9549
301 LG4 0.9548
302 CFP 0.9546
303 P92 0.9546
304 R8A 0.9545
305 6M1 0.9545
306 BDR 0.9545
307 ABV 0.9544
308 KJH 0.9543
309 7W1 0.9542
310 5AN 0.9542
311 1XM 0.9540
312 03V 0.9537
313 0CU 0.9537
314 MNM 0.9537
315 270 0.9536
316 SHG 0.9536
317 LGC 0.9536
318 4AA 0.9535
319 7WV 0.9535
320 JBK 0.9535
321 5AC 0.9534
322 AX7 0.9534
323 FUF 0.9533
324 RM4 0.9527
325 2MI 0.9525
326 CEJ 0.9525
327 5WX 0.9524
328 GAL 0.9522
329 WDL 0.9522
330 1XN 0.9521
331 HQT 0.9521
332 Z6J 0.9521
333 AZF 0.9520
334 JAE 0.9519
335 8NY 0.9518
336 DMJ 0.9518
337 286 0.9517
338 FE DB1 0.9516
339 5MK 0.9516
340 25R 0.9514
341 J1Z 0.9513
342 6M4 0.9512
343 5QX 0.9512
344 260 0.9512
345 4CH 0.9511
346 TH7 0.9510
347 IPH 0.9506
348 I3A 0.9503
349 150 0.9496
350 3Z7 0.9496
351 ES0 0.9495
352 4XR 0.9494
353 2ZX 0.9494
354 I1N 0.9493
355 CGB 0.9493
356 94B 0.9493
357 COU 0.9492
358 4XX 0.9492
359 LRH 0.9492
360 BML 0.9492
361 JB5 0.9491
362 RNS 0.9490
363 JZ1 0.9489
364 2AQ 0.9489
365 G3F 0.9487
366 23W 0.9486
367 ERH 0.9485
368 CWM 0.9484
369 AKH 0.9484
370 HX3 0.9481
371 SX1 0.9480
372 B57 0.9480
373 MLT 0.9479
374 L3Q 0.9476
375 GYE 0.9475
376 40O 0.9473
377 MB3 0.9471
378 DMD 0.9469
379 HH5 0.9469
380 MFB 0.9467
381 4FS 0.9466
382 7NI 0.9464
383 BEN 0.9464
384 BEZ 0.9463
385 XQG 0.9461
386 NCA 0.9461
387 HBA 0.9459
388 OCH 0.9458
389 ABE 0.9457
390 ES5 0.9457
391 KPL 0.9455
392 VNJ 0.9455
393 4JN 0.9452
394 BHO 0.9452
395 ISE 0.9451
396 HZQ 0.9451
397 PAF 0.9449
398 948 0.9446
399 DGJ 0.9445
400 GCS 0.9444
401 GLA 0.9442
402 4HS 0.9442
403 284 0.9442
404 KOJ 0.9441
405 KSW 0.9441
406 AFR 0.9439
407 FDB 0.9437
408 YHO 0.9436
409 2CQ 0.9434
410 A7W 0.9434
411 ICC 0.9433
412 2H5 0.9432
413 A2Q 0.9432
414 3ZQ 0.9430
415 5NU 0.9428
416 M2H 0.9428
417 TLA 0.9427
418 4PW 0.9427
419 3ID 0.9426
420 PA1 0.9426
421 DIE 0.9423
422 HXX 0.9423
423 DBJ 0.9421
424 MT0 0.9418
425 TBP 0.9418
426 9MG 0.9418
427 1PT 0.9416
428 MAN 0.9414
429 NBZ 0.9410
430 NIO 0.9410
431 EDG 0.9409
432 VAH 0.9408
433 SKA 0.9407
434 HY3 0.9405
435 LFR 0.9405
436 QWN 0.9402
437 3IT 0.9402
438 ECE 0.9401
439 9TZ 0.9401
440 ALO 0.9400
441 H3M 0.9400
442 H42 0.9399
443 UNC 0.9397
444 FA0 0.9395
445 9TY 0.9394
446 F4Z 0.9390
447 BHA 0.9390
448 AZ8 0.9389
449 DOB 0.9388
450 TEP 0.9388
451 36R 0.9388
452 GLF 0.9387
453 PE0 0.9386
454 12B 0.9386
455 6CS 0.9385
456 SOE 0.9384
457 GIO 0.9383
458 QX2 0.9383
459 3SK 0.9382
460 4M0 0.9382
461 5CU 0.9381
462 QWW 0.9381
463 RP7 0.9379
464 Q24 0.9378
465 HHA 0.9374
466 495 0.9374
467 GXL 0.9371
468 PHB 0.9371
469 2D0 0.9368
470 PYQ 0.9368
471 1P7 0.9367
472 TC7 0.9366
473 HPY 0.9366
474 BAM 0.9366
475 PFB 0.9365
476 CLW 0.9365
477 5VM 0.9363
478 45C 0.9362
479 LZM 0.9362
480 KBG 0.9361
481 MEW 0.9360
482 1P8 0.9358
483 IOL 0.9358
484 IF7 0.9356
485 SYV 0.9356
486 4VP 0.9356
487 42A 0.9355
488 R8S 0.9351
489 MMZ 0.9351
490 0W8 0.9350
491 2A7 0.9349
492 5B1 0.9348
493 IJZ 0.9348
494 BCP 0.9347
495 ALL 0.9346
496 FUB 0.9345
497 M6N 0.9344
498 VGD 0.9344
499 QXW 0.9344
500 HJP 0.9344
501 AQO 0.9342
502 QSC 0.9342
503 M0W 0.9341
504 B55 0.9341
505 YSO 0.9341
506 M5K 0.9340
507 MRW 0.9338
508 NEQ 0.9338
509 IV2 0.9334
510 7VJ 0.9333
511 BTY 0.9332
512 HLZ 0.9332
513 6KX 0.9327
514 42C 0.9327
515 ET2 0.9326
516 6PC 0.9326
517 V1L 0.9326
518 SVJ 0.9325
519 32X 0.9324
520 Q6T 0.9324
521 47J 0.9324
522 S76 0.9323
523 PZA 0.9323
524 R1X 0.9322
525 R2B 0.9322
526 TCZ 0.9322
527 EA1 0.9320
528 J9W 0.9320
529 CYH 0.9320
530 MFU 0.9318
531 2A9 0.9318
532 MSN 0.9318
533 2MH 0.9317
534 1U6 0.9315
535 DIN 0.9314
536 IMR 0.9314
537 ES2 0.9311
538 F0J 0.9311
539 BDF 0.9311
540 RSF 0.9310
541 XLS 0.9309
542 282 0.9309
543 5DI 0.9307
544 GAF 0.9306
545 KIB 0.9306
546 KIA 0.9306
547 SYN 0.9305
548 1AB 0.9305
549 MO8 0.9302
550 4HC 0.9301
551 12M 0.9299
552 X6X 0.9298
553 ILE 0.9298
554 MZW 0.9297
555 URC 0.9296
556 7VS 0.9295
557 DUC 0.9295
558 FH2 0.9294
559 3NT 0.9291
560 VGL 0.9290
561 0P6 0.9290
562 XM0 0.9289
563 SJ5 0.9288
564 M1Q 0.9286
565 HBX 0.9285
566 M1H 0.9284
567 5OB 0.9284
568 UNU 0.9284
569 NPO 0.9284
570 75K 0.9283
571 8CM 0.9283
572 AJ2 0.9282
573 AGK 0.9282
574 IPB 0.9282
575 1GN 0.9281
576 FDK 0.9280
577 I2M 0.9278
578 2FG 0.9277
579 285 0.9275
580 HIO 0.9274
581 FBB 0.9274
582 37T 0.9274
583 WOO 0.9272
584 DRL 0.9270
585 4HM 0.9269
586 SMV 0.9269
587 149 0.9268
588 M0Q 0.9267
589 C2U 0.9265
590 2EC 0.9263
591 HRZ 0.9263
592 9PO 0.9262
593 G1O 0.9261
594 VAL 0.9260
595 GIF 0.9260
596 2DR 0.9259
597 1LN 0.9258
598 8TX 0.9257
599 H76 0.9257
600 HAI 0.9257
601 MLA 0.9257
602 BSX 0.9256
603 V55 0.9254
604 LMR 0.9252
605 R8V 0.9252
606 NTN 0.9251
607 261 0.9251
608 IP0 0.9250
609 M58 0.9248
610 5JQ 0.9247
611 4M4 0.9244
612 EUG 0.9244
613 FOT 0.9244
614 H8N 0.9244
615 FBT 0.9243
616 DAB 0.9242
617 SWA 0.9242
618 FPK 0.9242
619 NBE 0.9239
620 BMA 0.9239
621 ABN 0.9239
622 CXL 0.9239
623 MBN 0.9238
624 RHU 0.9237
625 CWS 0.9236
626 2LP 0.9236
627 GAB 0.9235
628 WOT 0.9231
629 32O 0.9231
630 PYF 0.9229
631 K2T 0.9229
632 YIO 0.9228
633 5HN 0.9228
634 8IG 0.9226
635 95Z 0.9226
636 4JU 0.9226
637 3AB 0.9225
638 BDP 0.9224
639 GIV 0.9223
640 KT7 0.9221
641 3DO 0.9221
642 HVK 0.9220
643 2AP 0.9220
644 D3M 0.9219
645 MMA 0.9218
646 NQ 0.9217
647 FLA 0.9215
648 CN0 0.9215
649 O7U 0.9215
650 5JL 0.9211
651 3AP 0.9211
652 24T 0.9210
653 MLI 0.9210
654 329 0.9209
655 JUG 0.9208
656 4NC 0.9208
657 PRY 0.9207
658 DTI 0.9206
659 4AP 0.9206
660 ZZ3 0.9205
661 PY7 0.9203
662 NMJ 0.9203
663 LGA 0.9203
664 265 0.9201
665 FP1 0.9201
666 VK3 0.9200
667 25T 0.9196
668 3HB 0.9196
669 JZ4 0.9195
670 G4D 0.9193
671 P9P 0.9192
672 INO 0.9191
673 OVV 0.9191
674 2IM 0.9189
675 GXE 0.9187
676 54D 0.9186
677 ASP 0.9183
678 XAZ 0.9182
679 L60 0.9182
680 QBK 0.9180
681 SRT 0.9180
682 XYL 0.9179
683 RB5 0.9179
684 EYK 0.9179
685 86J 0.9176
686 KIV 0.9174
687 CTL 0.9173
688 PBE 0.9172
689 8CL 0.9172
690 DIU 0.9172
691 DMV 0.9172
692 DHQ 0.9165
693 NNO 0.9165
694 CFF 0.9164
695 XX2 0.9161
696 E60 0.9161
697 VNL 0.9161
698 KUF 0.9160
699 BZ3 0.9160
700 AC0 0.9159
701 826 0.9157
702 HBD 0.9157
703 RXA 0.9156
704 MBG 0.9154
705 4JM 0.9154
706 C2A 0.9154
707 MYJ 0.9152
708 5XC 0.9152
709 E7Z 0.9151
710 SW7 0.9151
711 OXC 0.9151
712 FX1 0.9151
713 OAA 0.9151
714 MR1 0.9150
715 280 0.9150
716 KG7 0.9150
717 2KT 0.9150
718 FBV 0.9149
719 1Y6 0.9149
720 FBA 0.9147
721 NTM 0.9146
722 THR 0.9146
723 2PC 0.9145
724 NK2 0.9144
725 P72 0.9143
726 ZWZ 0.9143
727 93K 0.9142
728 DHB 0.9142
729 1MR 0.9141
730 3BZ 0.9141
731 GLT 0.9141
732 PAB 0.9140
733 MAE 0.9140
734 PBZ 0.9139
735 LKA 0.9139
736 5RN 0.9139
737 2HO 0.9138
738 4DX 0.9138
739 15L 0.9137
740 FRU 0.9137
741 93B 0.9137
742 53C 0.9136
743 717 0.9135
744 SHA 0.9133
745 2ZQ 0.9133
746 YCP 0.9133
747 WCE 0.9133
748 1DH 0.9132
749 KLW 0.9132
750 G3E 0.9131
751 JBN 0.9131
752 B60 0.9130
753 TTL 0.9130
754 4JL 0.9130
755 N8P 0.9129
756 4MA 0.9128
757 RBL 0.9128
758 MRY 0.9128
759 NDM 0.9126
760 2HQ 0.9124
761 K17 0.9124
762 FOA 0.9124
763 34V 0.9124
764 3HM 0.9123
765 NID 0.9123
766 ZB1 0.9123
767 PBC 0.9123
768 92K 0.9122
769 SF9 0.9121
770 QSB 0.9121
771 Z82 0.9120
772 CIZ 0.9118
773 DXX 0.9117
774 8EZ 0.9116
775 JLZ 0.9116
776 4A3 0.9114
777 FHB 0.9113
778 RM1 0.9113
779 3MG 0.9112
780 HYN 0.9110
781 GT0 0.9108
782 JAB 0.9108
783 ASN 0.9105
784 174 0.9105
785 DBX 0.9104
786 C21 0.9101
787 PHT 0.9101
788 LYL 0.9100
789 TBS 0.9099
790 DTL 0.9097
791 CTS 0.9097
792 7D2 0.9096
793 5WY 0.9095
794 URQ 0.9093
795 PAV 0.9093
796 9TW 0.9092
797 HHN 0.9092
798 PRO 0.9091
799 UQ 0.9089
800 MS9 0.9087
801 KP6 0.9087
802 CNL 0.9087
803 TP5 0.9086
804 SE2 0.9086
805 PYC 0.9085
806 AZ9 0.9084
807 TZC 0.9084
808 GXY 0.9082
809 GOG 0.9080
810 4CS 0.9079
811 CHB 0.9078
812 SFU 0.9076
813 TTO 0.9075
814 7ZE 0.9075
815 WTZ 0.9075
816 NDH 0.9074
817 HQD 0.9073
818 CRN 0.9073
819 B0D 0.9072
820 ZVO 0.9071
821 9CL 0.9071
822 PQ0 0.9070
823 INE 0.9070
824 4JT 0.9069
825 C2B 0.9069
826 BRT 0.9068
827 KJU 0.9067
828 AUD 0.9065
829 X09 0.9065
830 XUL 0.9065
831 FPI 0.9065
832 ISZ 0.9064
833 51F 0.9064
834 680 0.9063
835 FB1 0.9056
836 3OC 0.9056
837 HSE 0.9055
838 GCB 0.9053
839 MAQ 0.9047
840 QFH 0.9047
841 RUU 0.9047
842 3R6 0.9047
843 2GS 0.9046
844 FAN 0.9044
845 ASC 0.9043
846 PBR 0.9043
847 LSA 0.9042
848 4AX 0.9042
849 APZ 0.9041
850 LER 0.9040
851 TZE 0.9039
852 DEE 0.9036
853 ZXD 0.9035
854 PRS 0.9031
855 RPQ 0.9030
856 8GC 0.9030
857 DPR 0.9030
858 PRF 0.9030
859 XIX 0.9027
860 DZX 0.9025
861 VOH 0.9024
862 1M2 0.9024
863 D07 0.9024
864 LDU 0.9023
865 DMI 0.9023
866 ORO 0.9021
867 EKZ 0.9019
868 TTY 0.9019
869 7EX 0.9019
870 IT2 0.9018
871 D1X 0.9018
872 TFU 0.9017
873 8WT 0.9016
874 2BG 0.9015
875 2MN 0.9014
876 0FN 0.9014
877 SF6 0.9012
878 AC6 0.9011
879 AH8 0.9008
880 URP 0.9006
881 TNE 0.9005
882 PIH 0.9004
883 N7P 0.9003
884 PZM 0.9003
885 4Z4 0.9002
886 APY 0.9001
887 4MU 0.9001
888 3DY 0.9001
889 IHB 0.9000
890 PSV 0.9000
891 3FH 0.8999
892 SR1 0.8997
893 IPZ 0.8997
894 XIY 0.8996
895 XHP 0.8996
896 3Z8 0.8996
897 J5I 0.8994
898 FBM 0.8994
899 8WO 0.8991
900 AKB 0.8991
901 173 0.8989
902 4YO 0.8989
903 MUA 0.8989
904 NIZ 0.8988
905 278 0.8987
906 23B 0.8984
907 ICO 0.8983
908 K5W 0.8980
909 PYJ 0.8979
910 FQI 0.8978
911 34D 0.8978
912 JZ5 0.8978
913 AMC 0.8977
914 AW5 0.8976
915 KBB 0.8975
916 F9Y 0.8975
917 B24 0.8974
918 DGY 0.8974
919 GLU 0.8973
920 HGW 0.8973
921 QPR 0.8973
922 5GU 0.8971
923 BP9 0.8970
924 MWP 0.8969
925 DOR 0.8969
926 SS1 0.8968
927 8ZE 0.8966
928 3PF 0.8965
929 MQN 0.8964
930 3MB 0.8964
931 C5J 0.8963
932 6RQ 0.8962
933 TFB 0.8962
934 OVM 0.8961
935 CAM 0.8960
936 LT2 0.8959
937 CLZ 0.8957
938 CFI 0.8955
939 X05 0.8953
940 GCU 0.8953
941 GDE 0.8952
942 ITN 0.8951
943 XBT 0.8950
944 MZB 0.8949
945 0N7 0.8948
946 98J 0.8944
947 4RW 0.8943
948 QAT 0.8943
949 PHH 0.8941
950 0TU 0.8940
951 SOR 0.8934
952 EVA 0.8933
953 4JQ 0.8932
954 ZBT 0.8931
955 DHK 0.8929
956 SIN 0.8926
957 06B 0.8923
958 JXN 0.8923
959 BNT 0.8923
960 FSW 0.8922
961 9X7 0.8919
962 B62 0.8918
963 PCA 0.8918
964 OTW 0.8916
965 NCM 0.8913
966 SYA 0.8908
967 SS2 0.8907
968 SER 0.8906
969 44W 0.8906
970 3V4 0.8904
971 0FO 0.8904
972 AEF 0.8904
973 14J 0.8904
974 1AC 0.8904
975 F12 0.8903
976 HNQ 0.8902
977 F31 0.8900
978 PTO 0.8899
979 GZ8 0.8898
980 HZP 0.8897
981 8EW 0.8897
982 MRZ 0.8897
983 ADA 0.8896
984 GOX 0.8892
985 JZ7 0.8891
986 DQU 0.8891
987 51R 0.8891
988 A65 0.8887
989 AMG 0.8886
990 MT5 0.8885
991 N2I 0.8880
992 HSL 0.8880
993 OW4 0.8879
994 TOF 0.8878
995 HYP 0.8877
996 23J 0.8875
997 DTU 0.8875
998 UY7 0.8873
999 7ME 0.8871
1000 9KT 0.8870
1001 NTZ 0.8870
1002 DSN 0.8870
1003 4XV 0.8870
1004 QX4 0.8868
1005 ATQ 0.8868
1006 PZI 0.8865
1007 OHG 0.8865
1008 44V 0.8864
1009 F1A 0.8864
1010 GZL 0.8861
1011 1DU 0.8858
1012 PDC 0.8853
1013 3SL 0.8851
1014 3PY 0.8851
1015 LDP 0.8850
1016 GYP 0.8847
1017 273 0.8844
1018 MXN 0.8844
1019 DAS 0.8843
1020 1P3 0.8841
1021 AKG 0.8841
1022 HTP 0.8839
1023 KFH 0.8839
1024 6JN 0.8839
1025 MVL 0.8838
1026 5QY 0.8836
1027 DMG 0.8834
1028 ENL 0.8831
1029 SVD 0.8830
1030 UYA 0.8829
1031 40E 0.8829
1032 P2D 0.8826
1033 TCM 0.8823
1034 MA3 0.8822
1035 PEP 0.8819
1036 GIM 0.8819
1037 QAS 0.8818
1038 0JD 0.8818
1039 AOS 0.8818
1040 BCU 0.8815
1041 SKM 0.8814
1042 4XS 0.8814
1043 4ME 0.8813
1044 6VD 0.8813
1045 NVI 0.8813
1046 7B3 0.8812
1047 1DQ 0.8812
1048 AAE 0.8812
1049 T9G 0.8808
1050 IFP 0.8805
1051 6ME 0.8805
1052 PRZ 0.8804
1053 42J 0.8801
1054 UAN 0.8799
1055 SXS 0.8796
1056 JND 0.8795
1057 HY1 0.8794
1058 QSH 0.8794
1059 FHN 0.8793
1060 NVA 0.8790
1061 DCD 0.8790
1062 308 0.8790
1063 JTH 0.8783
1064 8XQ 0.8782
1065 SKG 0.8781
1066 RSO 0.8781
1067 GCV 0.8781
1068 CAH 0.8781
1069 BNS 0.8775
1070 NXA 0.8774
1071 AEZ 0.8774
1072 5RO 0.8773
1073 FAC 0.8772
1074 XCZ 0.8771
1075 GTR 0.8770
1076 R9S 0.8770
1077 YRL 0.8768
1078 HIU 0.8767
1079 SYG 0.8766
1080 HUI 0.8764
1081 NK1 0.8763
1082 PKU 0.8763
1083 XRG 0.8761
1084 FCR 0.8759
1085 RXR 0.8758
1086 9RW 0.8757
1087 ODO 0.8756
1088 2CL 0.8756
1089 HA7 0.8754
1090 BAE 0.8754
1091 BVC 0.8754
1092 X0V 0.8750
1093 RMN 0.8748
1094 ABA 0.8748
1095 7N0 0.8747
1096 TGX 0.8745
1097 GLL 0.8743
1098 4TU 0.8742
1099 OA3 0.8741
1100 EV0 0.8741
1101 CYS 0.8740
1102 GLY PRO 0.8738
1103 8OZ 0.8737
1104 IQ0 0.8736
1105 OVP 0.8736
1106 II6 0.8736
1107 4P5 0.8729
1108 9X6 0.8729
1109 GTZ 0.8729
1110 DTT 0.8726
1111 4FA 0.8726
1112 HCS 0.8725
1113 2AL 0.8725
1114 GCW 0.8723
1115 OK7 0.8723
1116 CP 0.8720
1117 GTL 0.8718
1118 PAE 0.8717
1119 FLV 0.8714
1120 AS3 0.8711
1121 TSU 0.8708
1122 0HO 0.8702
1123 EMZ 0.8697
1124 PQK 0.8687
1125 TSS 0.8672
1126 SNE 0.8671
1127 PMB 0.8669
1128 J9T 0.8669
1129 MIG 0.8668
1130 192 0.8666
1131 FA1 0.8662
1132 TMH 0.8661
1133 1DV 0.8659
1134 3NY 0.8658
1135 K34 0.8657
1136 PEL 0.8657
1137 6NT 0.8656
1138 PBA 0.8654
1139 7WG 0.8652
1140 3C2 0.8651
1141 E5X 0.8650
1142 GCO 0.8648
1143 0HN 0.8645
1144 4P0 0.8643
1145 A13 0.8643
1146 9FL 0.8643
1147 PEA 0.8641
1148 PNZ 0.8637
1149 HDA 0.8637
1150 1F1 0.8635
1151 OMD 0.8628
1152 271 0.8624
1153 K32 0.8619
1154 3C1 0.8619
1155 ANN 0.8618
1156 9PY 0.8617
1157 TWO 0.8612
1158 TAY 0.8606
1159 2ZM 0.8603
1160 BFM 0.8601
1161 4ZA 0.8601
1162 CXF 0.8600
1163 DCY 0.8597
1164 PSJ 0.8590
1165 PPF 0.8589
1166 6NI 0.8587
1167 PHU 0.8584
1168 BVG 0.8580
1169 CEE 0.8576
1170 3A9 0.8573
1171 MZ0 0.8571
1172 HQ9 0.8571
1173 HIS 0.8562
1174 97T 0.8556
1175 HLT 0.8536
1176 HSM 0.8533
1177 BNZ 0.8510
Ligand no: 2; Ligand: XYS; Similar ligands found: 1058
No: Ligand Similarity coefficient
1 PYG 1.0354
2 URA 0.9953
3 CRS 0.9911
4 CAQ 0.9888
5 26D 0.9887
6 3FA 0.9870
7 2C9 0.9850
8 MBD 0.9850
9 2MY 0.9840
10 FFP 0.9840
11 FLM 0.9830
12 2CM 0.9820
13 3MC 0.9810
14 HGQ 0.9803
15 GMN 0.9800
16 3MH 0.9790
17 DUB 0.9790
18 6UA 0.9783
19 6MH 0.9780
20 WBU 0.9772
21 3CE 0.9770
22 RAM 0.9763
23 JZ3 0.9759
24 URF 0.9754
25 0TR 0.9741
26 BEW 0.9736
27 XBZ 0.9733
28 YTB 0.9728
29 TDR 0.9728
30 FUC 0.9726
31 ICP 0.9725
32 PYD 0.9725
33 FUL 0.9723
34 MWM 0.9722
35 2MP 0.9716
36 4ZE 0.9716
37 1MC 0.9715
38 MCT 0.9715
39 2AC 0.9715
40 34A 0.9713
41 A1U 0.9710
42 QOS 0.9710
43 275 0.9710
44 7CZ 0.9703
45 IFM 0.9700
46 XYD 0.9698
47 23A 0.9697
48 DFU 0.9692
49 NK 0.9691
50 4HO 0.9689
51 SWD 0.9683
52 NOJ 0.9678
53 ADE 0.9677
54 ASO 0.9672
55 G2F 0.9672
56 BTE 0.9669
57 TM7 0.9662
58 94N 0.9660
59 43M 0.9658
60 HT4 0.9658
61 TH0 0.9656
62 2YU 0.9656
63 AHR 0.9654
64 GLC 0.9653
65 5UC 0.9648
66 XXR 0.9646
67 IDH 0.9646
68 JZ2 0.9645
69 FUB 0.9645
70 4JJ 0.9643
71 HPA 0.9641
72 MZG 0.9640
73 4CL 0.9638
74 FYU 0.9637
75 5MH 0.9636
76 3RK 0.9633
77 IFL 0.9630
78 NOY 0.9628
79 LCN 0.9625
80 5JC 0.9622
81 9DA 0.9613
82 4JO 0.9612
83 RNS 0.9610
84 TM4 0.9606
85 FCA 0.9605
86 IPH 0.9603
87 BGC 0.9602
88 RM4 0.9600
89 TMT 0.9600
90 BR9 0.9597
91 1XX 0.9595
92 6MP 0.9589
93 MWJ 0.9589
94 CEJ 0.9585
95 R8A 0.9583
96 27Y 0.9582
97 F81 0.9582
98 7WA 0.9581
99 FCB 0.9580
100 BP1 0.9579
101 9HX 0.9578
102 M1A 0.9576
103 82I 0.9572
104 7HP 0.9568
105 5Q0 0.9562
106 HFB 0.9560
107 MB3 0.9560
108 GOO 0.9558
109 EQT 0.9555
110 2XX 0.9554
111 10L 0.9553
112 G6D 0.9547
113 DFB 0.9543
114 PM6 0.9543
115 ADK 0.9543
116 TLD 0.9542
117 L89 0.9541
118 AZF 0.9540
119 TMZ 0.9540
120 5SG 0.9540
121 OXE 0.9539
122 NPY 0.9538
123 FP2 0.9536
124 ES4 0.9533
125 GRE 0.9533
126 HQY 0.9532
127 67N 0.9531
128 3DM 0.9526
129 FUF 0.9523
130 2AF 0.9523
131 QUZ 0.9521
132 39A 0.9518
133 OXZ 0.9517
134 Y8I 0.9515
135 1AN 0.9513
136 93Q 0.9513
137 7W4 0.9513
138 JFD 0.9512
139 76X 0.9511
140 JZ0 0.9511
141 ABE 0.9510
142 EXO 0.9509
143 92Z 0.9509
144 INS 0.9508
145 3WA 0.9508
146 0R0 0.9507
147 MNM 0.9506
148 O72 0.9505
149 1NP 0.9505
150 8LG 0.9503
151 2CH 0.9502
152 6F0 0.9502
153 0CT 0.9498
154 ADZ 0.9498
155 8H8 0.9497
156 KYD 0.9496
157 IUR 0.9495
158 4YS 0.9492
159 1LQ 0.9491
160 ISN 0.9490
161 F05 0.9489
162 3MA 0.9488
163 IND 0.9488
164 ES1 0.9488
165 23W 0.9488
166 P3K 0.9486
167 HTS 0.9485
168 GVH 0.9485
169 BCF 0.9484
170 A2Q 0.9482
171 40O 0.9480
172 284 0.9480
173 DMJ 0.9478
174 DEN 0.9477
175 1SQ 0.9477
176 KKN 0.9476
177 BZF 0.9474
178 25W 0.9472
179 JPZ 0.9471
180 4JP 0.9470
181 IDM 0.9469
182 1LM 0.9468
183 BZI 0.9467
184 BZX 0.9465
185 6HQ 0.9465
186 3XX 0.9464
187 5WV 0.9463
188 0R1 0.9462
189 5IQ 0.9462
190 YAN 0.9461
191 MFB 0.9460
192 260 0.9460
193 GLF 0.9459
194 938 0.9459
195 HMH 0.9458
196 OXQ 0.9456
197 JBQ 0.9456
198 Z6J 0.9454
199 ES7 0.9453
200 RCO 0.9450
201 4XX 0.9450
202 SAL 0.9449
203 F5B 0.9448
204 N5J 0.9448
205 32O 0.9446
206 9EW 0.9444
207 6AI 0.9444
208 286 0.9444
209 JBH 0.9443
210 MPI 0.9441
211 BBF 0.9441
212 JIF 0.9440
213 GUN 0.9440
214 PXL 0.9439
215 FPN 0.9439
216 MAN 0.9435
217 YHO 0.9435
218 TLA 0.9435
219 4PW 0.9433
220 3U4 0.9433
221 KSW 0.9433
222 7B4 0.9431
223 3ZQ 0.9430
224 LG3 0.9430
225 RIB 0.9429
226 KJY 0.9429
227 R2B 0.9426
228 R1X 0.9426
229 LZ1 0.9424
230 PLQ 0.9424
231 KPL 0.9424
232 1WG 0.9421
233 24W 0.9421
234 7MH 0.9420
235 HH8 0.9419
236 3M0 0.9418
237 CYH 0.9418
238 V1L 0.9417
239 948 0.9416
240 IMR 0.9414
241 94B 0.9413
242 XAN 0.9413
243 UEG 0.9412
244 GBD 0.9412
245 CYT 0.9410
246 FPY 0.9410
247 JZ9 0.9405
248 4XH 0.9404
249 2ZV 0.9403
250 SVN 0.9401
251 T6C 0.9401
252 L3Q 0.9400
253 3CH 0.9400
254 8GF 0.9400
255 3F0 0.9399
256 MMZ 0.9399
257 RP7 0.9398
258 HQE 0.9396
259 ZZT 0.9394
260 PA1 0.9392
261 BVF 0.9390
262 LG5 0.9390
263 9DG 0.9389
264 DGJ 0.9388
265 6X8 0.9387
266 DUC 0.9387
267 BDR 0.9386
268 LGC 0.9386
269 F3B 0.9384
270 6LW 0.9383
271 35C 0.9383
272 24B 0.9380
273 PCR 0.9380
274 6M9 0.9378
275 NEQ 0.9377
276 RSF 0.9375
277 IBF 0.9374
278 1PT 0.9374
279 MAK 0.9373
280 14O 0.9373
281 PAF 0.9372
282 HMU 0.9371
283 G3F 0.9368
284 1WD 0.9368
285 B53 0.9363
286 DA1 0.9363
287 SOE 0.9362
288 BE2 0.9361
289 5H1 0.9360
290 4CH 0.9359
291 LG4 0.9358
292 GIO 0.9357
293 GCS 0.9357
294 60P 0.9356
295 HPY 0.9356
296 GAL 0.9355
297 PXM 0.9353
298 G5V 0.9353
299 5MB 0.9353
300 HBX 0.9353
301 JKE 0.9352
302 KBG 0.9351
303 PXY 0.9350
304 4SV 0.9349
305 F60 0.9348
306 ABN 0.9348
307 NSP 0.9346
308 3HA 0.9346
309 DBH 0.9346
310 AGK 0.9344
311 AFR 0.9344
312 0RW 0.9342
313 2CK 0.9342
314 CIG 0.9340
315 B3R 0.9340
316 IF7 0.9339
317 DQN 0.9339
318 4DX 0.9338
319 JAE 0.9337
320 ICC 0.9336
321 25R 0.9332
322 12Q 0.9331
323 JBE 0.9329
324 5MI 0.9327
325 BMA 0.9326
326 1DW 0.9326
327 1AB 0.9324
328 HLR 0.9324
329 MZW 0.9323
330 TH7 0.9321
331 MSN 0.9320
332 PAV 0.9320
333 GAG 0.9320
334 SHG 0.9319
335 8S0 0.9317
336 CGB 0.9316
337 ES6 0.9315
338 2K4 0.9315
339 I1N 0.9314
340 HQT 0.9312
341 6M1 0.9312
342 GIF 0.9310
343 JZ1 0.9310
344 4H2 0.9310
345 OAA 0.9309
346 AZA 0.9308
347 IGA 0.9308
348 5AC 0.9306
349 PCI 0.9303
350 KJH 0.9303
351 ISE 0.9302
352 HAI 0.9300
353 7WV 0.9295
354 ES9 0.9295
355 M1E 0.9295
356 7W1 0.9294
357 URQ 0.9291
358 MLA 0.9291
359 HEW 0.9290
360 M3T 0.9290
361 P92 0.9289
362 ECE 0.9288
363 GLA 0.9288
364 5QX 0.9286
365 1XN 0.9285
366 A2F 0.9285
367 ARW 0.9284
368 EDG 0.9284
369 J1Z 0.9283
370 PTO 0.9282
371 CFP 0.9281
372 3Z7 0.9280
373 BR8 0.9280
374 WDL 0.9280
375 AX2 0.9280
376 CXL 0.9279
377 11S 0.9278
378 270 0.9274
379 AX7 0.9274
380 6KX 0.9271
381 FE DB1 0.9271
382 6AP 0.9271
383 YH7 0.9271
384 13X 0.9270
385 HY3 0.9269
386 MLI 0.9269
387 BDF 0.9266
388 DMV 0.9264
389 XQ0 0.9264
390 290 0.9264
391 34V 0.9260
392 H76 0.9260
393 3AY 0.9260
394 FK1 0.9257
395 KOJ 0.9256
396 ABV 0.9255
397 4JU 0.9254
398 2MH 0.9254
399 PFB 0.9254
400 Q88 0.9253
401 6M4 0.9253
402 2IM 0.9253
403 VNJ 0.9252
404 TNE 0.9251
405 5ZE 0.9250
406 ES0 0.9250
407 2MI 0.9249
408 BML 0.9249
409 L60 0.9249
410 COU 0.9247
411 MLT 0.9247
412 5WX 0.9247
413 GTQ 0.9246
414 03V 0.9246
415 AZG 0.9245
416 2DR 0.9244
417 CWM 0.9243
418 5CL 0.9243
419 2KT 0.9243
420 5RG 0.9242
421 GXL 0.9241
422 B57 0.9238
423 5M0 0.9237
424 SWA 0.9235
425 6GU 0.9235
426 H3M 0.9234
427 XLS 0.9233
428 1XM 0.9232
429 TBP 0.9230
430 H4N 0.9228
431 GIV 0.9227
432 SYN 0.9225
433 4HS 0.9224
434 4AA 0.9221
435 141 0.9220
436 150 0.9219
437 HZQ 0.9219
438 JB5 0.9215
439 12M 0.9214
440 4ZC 0.9214
441 G4D 0.9213
442 O7U 0.9212
443 DX4 0.9211
444 I3A 0.9210
445 DAB 0.9209
446 4JN 0.9209
447 HX3 0.9208
448 54G 0.9206
449 HHA 0.9205
450 HH5 0.9204
451 MT0 0.9204
452 ALO 0.9203
453 9TY 0.9203
454 GAF 0.9203
455 XM0 0.9202
456 GYE 0.9201
457 HHQ 0.9200
458 HBA 0.9200
459 BEZ 0.9199
460 95Z 0.9196
461 HXX 0.9195
462 3ID 0.9195
463 2AQ 0.9193
464 MFU 0.9193
465 DIE 0.9191
466 TAR 0.9191
467 4FS 0.9189
468 FRU 0.9188
469 WOO 0.9187
470 3DY 0.9186
471 RUU 0.9185
472 45C 0.9185
473 DIG 0.9184
474 OCH 0.9184
475 0CU 0.9183
476 YIO 0.9182
477 3SK 0.9181
478 ES5 0.9181
479 2ZX 0.9180
480 DMD 0.9180
481 ERH 0.9180
482 N7P 0.9176
483 JBK 0.9176
484 BOA 0.9174
485 PYQ 0.9174
486 LRH 0.9172
487 XUL 0.9172
488 285 0.9172
489 3DO 0.9170
490 KIV 0.9169
491 7HQ 0.9168
492 NCA 0.9166
493 LDU 0.9165
494 495 0.9165
495 SJ5 0.9161
496 2CQ 0.9160
497 ASC 0.9159
498 ROR 0.9158
499 VAH 0.9158
500 5MK 0.9156
501 A7W 0.9156
502 5NU 0.9154
503 BDP 0.9153
504 4AX 0.9153
505 FPK 0.9152
506 PZA 0.9152
507 FH2 0.9149
508 8NY 0.9148
509 NBZ 0.9147
510 SVJ 0.9146
511 6CS 0.9145
512 R8V 0.9145
513 THR 0.9145
514 FDK 0.9144
515 QWN 0.9143
516 FA0 0.9142
517 SKA 0.9140
518 MBN 0.9140
519 2FG 0.9138
520 1P7 0.9137
521 FDB 0.9136
522 H42 0.9136
523 4XR 0.9133
524 DOB 0.9131
525 2D0 0.9131
526 GLT 0.9130
527 2H5 0.9129
528 BHA 0.9129
529 1LN 0.9127
530 BEN 0.9127
531 X6X 0.9127
532 4M0 0.9127
533 CIZ 0.9126
534 ZWZ 0.9120
535 BSX 0.9120
536 9PO 0.9120
537 IOL 0.9118
538 TC7 0.9117
539 7EX 0.9117
540 8EZ 0.9113
541 149 0.9113
542 ALL 0.9113
543 VAL 0.9111
544 4AP 0.9110
545 HVK 0.9110
546 AUD 0.9106
547 32X 0.9105
548 5CU 0.9104
549 ASP 0.9100
550 12B 0.9099
551 5DI 0.9097
552 BHO 0.9096
553 280 0.9096
554 282 0.9095
555 X09 0.9094
556 ILE 0.9093
557 SX1 0.9092
558 BCP 0.9091
559 YSO 0.9091
560 7VJ 0.9090
561 2AP 0.9090
562 3AP 0.9090
563 UNC 0.9090
564 HRZ 0.9090
565 KG7 0.9090
566 1GN 0.9088
567 DBJ 0.9087
568 47J 0.9086
569 G1O 0.9085
570 MEW 0.9085
571 MBG 0.9084
572 AZ8 0.9084
573 FX1 0.9082
574 4VP 0.9082
575 RB5 0.9081
576 1U6 0.9080
577 F4Z 0.9080
578 PE0 0.9080
579 LGA 0.9080
580 ZB1 0.9078
581 TTL 0.9077
582 36R 0.9076
583 1MR 0.9075
584 DTI 0.9070
585 Q24 0.9070
586 MRW 0.9070
587 8CL 0.9070
588 MZB 0.9069
589 LMR 0.9069
590 DAS 0.9069
591 SRT 0.9068
592 5B1 0.9068
593 5AN 0.9066
594 2EC 0.9065
595 EA1 0.9065
596 ZZ3 0.9065
597 HLZ 0.9064
598 NIO 0.9062
599 SYV 0.9058
600 BAM 0.9058
601 ASN 0.9056
602 B55 0.9056
603 DIN 0.9056
604 F0J 0.9055
605 AKB 0.9053
606 CRN 0.9051
607 FP1 0.9050
608 TCZ 0.9050
609 PBE 0.9049
610 CTS 0.9049
611 QXW 0.9048
612 329 0.9046
613 M58 0.9046
614 9TZ 0.9046
615 B0D 0.9044
616 DTL 0.9044
617 TEP 0.9043
618 C2A 0.9043
619 PHB 0.9041
620 CLW 0.9041
621 HYN 0.9040
622 CTL 0.9038
623 KIB 0.9038
624 FLA 0.9036
625 41K 0.9035
626 HIO 0.9035
627 93B 0.9035
628 4HM 0.9033
629 M5K 0.9032
630 5VM 0.9032
631 CAM 0.9031
632 3MG 0.9030
633 GXE 0.9030
634 0P6 0.9030
635 M2H 0.9027
636 N8P 0.9026
637 8CM 0.9023
638 6PC 0.9023
639 2A9 0.9022
640 7D2 0.9021
641 Q6T 0.9021
642 ES2 0.9021
643 BTY 0.9020
644 24T 0.9020
645 PYF 0.9019
646 265 0.9019
647 DGY 0.9019
648 AQO 0.9018
649 VGL 0.9017
650 NK2 0.9017
651 ITN 0.9016
652 J9W 0.9016
653 CN0 0.9016
654 URP 0.9015
655 7VS 0.9015
656 LYL 0.9013
657 3IT 0.9013
658 QSC 0.9013
659 PYJ 0.9013
660 IP0 0.9012
661 RM1 0.9011
662 RBL 0.9009
663 2A7 0.9009
664 AKH 0.9009
665 HJP 0.9006
666 XQG 0.9006
667 IV2 0.9005
668 IJZ 0.9004
669 M0W 0.9004
670 VGD 0.9004
671 CNL 0.9003
672 NQ 0.9001
673 LER 0.9000
674 TTO 0.9000
675 WOT 0.8999
676 R8S 0.8999
677 1P8 0.8999
678 VK3 0.8999
679 TCM 0.8998
680 MMA 0.8997
681 NBE 0.8997
682 V55 0.8997
683 GAB 0.8996
684 BAE 0.8995
685 51F 0.8993
686 MRY 0.8993
687 URC 0.8993
688 9MG 0.8992
689 QFH 0.8990
690 ET2 0.8989
691 I2M 0.8987
692 42C 0.8985
693 MRZ 0.8984
694 TFB 0.8983
695 3NT 0.8983
696 MO8 0.8982
697 CWS 0.8982
698 JUG 0.8981
699 4NC 0.8981
700 UNU 0.8981
701 IPB 0.8980
702 37T 0.8980
703 2HQ 0.8980
704 M1Q 0.8979
705 0W8 0.8978
706 8TX 0.8977
707 C5J 0.8977
708 4HC 0.8976
709 NPO 0.8976
710 4M4 0.8972
711 EUG 0.8972
712 M0Q 0.8972
713 AC5 0.8971
714 GLU 0.8971
715 APY 0.8969
716 FBT 0.8965
717 PRO 0.8964
718 YCP 0.8963
719 75K 0.8962
720 3PY 0.8961
721 GLL 0.8960
722 ZBT 0.8960
723 WTZ 0.8959
724 2PC 0.8959
725 86J 0.8958
726 261 0.8957
727 RHU 0.8957
728 7NI 0.8957
729 KIA 0.8956
730 8IG 0.8956
731 NMJ 0.8956
732 RPQ 0.8955
733 FBA 0.8955
734 ZXD 0.8955
735 IQ0 0.8954
736 KP6 0.8952
737 FBB 0.8952
738 RXA 0.8951
739 192 0.8951
740 BAQ 0.8951
741 JZ4 0.8950
742 HHN 0.8950
743 FPI 0.8949
744 25T 0.8948
745 AJ2 0.8946
746 NTN 0.8945
747 FOT 0.8944
748 DRL 0.8944
749 DXX 0.8943
750 4JM 0.8942
751 PY7 0.8941
752 ISD 0.8940
753 3OC 0.8940
754 HSL 0.8940
755 LZM 0.8940
756 SKG 0.8938
757 B24 0.8938
758 LFR 0.8937
759 E7Z 0.8935
760 VNL 0.8935
761 42A 0.8934
762 H8N 0.8933
763 LKA 0.8931
764 CAH 0.8931
765 1AC 0.8930
766 DHB 0.8929
767 PRY 0.8926
768 D3M 0.8925
769 TMH 0.8925
770 4CS 0.8924
771 IT9 0.8924
772 DSN 0.8923
773 PSV 0.8922
774 SER 0.8922
775 CFF 0.8922
776 PIH 0.8920
777 NK1 0.8919
778 NCM 0.8918
779 DHQ 0.8916
780 5JQ 0.8916
781 SMV 0.8916
782 SF6 0.8915
783 PRS 0.8915
784 TZE 0.8911
785 2MN 0.8911
786 DZX 0.8910
787 E60 0.8910
788 SIN 0.8910
789 278 0.8910
790 SF9 0.8909
791 AMC 0.8908
792 23B 0.8906
793 M1H 0.8906
794 NXA 0.8905
795 JBN 0.8905
796 FOA 0.8903
797 C2U 0.8903
798 3HB 0.8903
799 2LP 0.8901
800 GCU 0.8899
801 SHA 0.8899
802 NTM 0.8899
803 AC0 0.8899
804 A3B 0.8899
805 XX2 0.8899
806 KUF 0.8899
807 3V4 0.8899
808 XBT 0.8897
809 DTU 0.8897
810 4RW 0.8896
811 NNO 0.8895
812 S76 0.8892
813 SR1 0.8892
814 ATQ 0.8892
815 UY7 0.8891
816 IOM 0.8890
817 MYJ 0.8889
818 INO 0.8889
819 5JL 0.8888
820 93K 0.8888
821 DPR 0.8887
822 15L 0.8887
823 3Z8 0.8887
824 GYP 0.8885
825 PYC 0.8885
826 717 0.8885
827 GCB 0.8884
828 53C 0.8884
829 P9P 0.8883
830 IT2 0.8881
831 PCA 0.8881
832 2HO 0.8881
833 NVI 0.8881
834 K2T 0.8880
835 T2C 0.8878
836 GG6 0.8878
837 DIU 0.8878
838 NDM 0.8877
839 DCD 0.8877
840 GTL 0.8875
841 PBC 0.8875
842 2GS 0.8874
843 3AB 0.8874
844 XAZ 0.8874
845 SFU 0.8874
846 KLW 0.8872
847 4JL 0.8872
848 9CL 0.8872
849 OHG 0.8872
850 1DH 0.8871
851 OVV 0.8870
852 LSA 0.8869
853 FBV 0.8867
854 680 0.8865
855 5HN 0.8864
856 HBD 0.8864
857 826 0.8864
858 DMG 0.8864
859 IPZ 0.8863
860 HSE 0.8861
861 3HM 0.8861
862 DMI 0.8860
863 PHT 0.8860
864 98J 0.8859
865 TZC 0.8859
866 MR1 0.8856
867 JLZ 0.8856
868 TFU 0.8855
869 4JT 0.8854
870 ADO 0.8854
871 TBS 0.8854
872 C21 0.8852
873 4A3 0.8852
874 54D 0.8852
875 FHB 0.8849
876 AAE 0.8848
877 VOH 0.8846
878 5RN 0.8846
879 MXN 0.8846
880 ZVO 0.8845
881 PBZ 0.8841
882 9TW 0.8840
883 GXY 0.8838
884 DBX 0.8838
885 BZ3 0.8838
886 OXC 0.8838
887 C2B 0.8837
888 HYP 0.8836
889 EYK 0.8835
890 K17 0.8835
891 PEP 0.8834
892 GT0 0.8834
893 1P3 0.8832
894 P72 0.8832
895 5OB 0.8830
896 2ZQ 0.8826
897 CAE 0.8826
898 1Y6 0.8825
899 PAB 0.8824
900 XIX 0.8822
901 AZ9 0.8822
902 CHB 0.8821
903 QX2 0.8819
904 4MA 0.8819
905 Z82 0.8814
906 HQD 0.8811
907 HGW 0.8810
908 8WT 0.8810
909 SVD 0.8808
910 BP9 0.8806
911 SS2 0.8802
912 WCE 0.8802
913 BVC 0.8800
914 EVA 0.8797
915 1DQ 0.8792
916 3BZ 0.8790
917 FB1 0.8790
918 QSB 0.8789
919 H62 0.8788
920 TP5 0.8788
921 G3E 0.8788
922 14J 0.8785
923 OEM 0.8784
924 40E 0.8778
925 3SL 0.8778
926 9X6 0.8778
927 MAE 0.8777
928 RXR 0.8777
929 HDA 0.8776
930 MA3 0.8776
931 CFI 0.8773
932 308 0.8773
933 UYA 0.8771
934 PAE 0.8771
935 FAN 0.8769
936 8GC 0.8768
937 AC6 0.8767
938 PQ0 0.8767
939 5GU 0.8764
940 2BN 0.8764
941 BRT 0.8763
942 FA1 0.8761
943 ISZ 0.8761
944 CYS 0.8760
945 SYG 0.8758
946 FSW 0.8757
947 ABA 0.8756
948 DEE 0.8755
949 MT5 0.8755
950 EKZ 0.8751
951 SE2 0.8751
952 PRF 0.8750
953 PBR 0.8750
954 3SY 0.8749
955 2TQ 0.8746
956 HIU 0.8746
957 GCV 0.8745
958 IHB 0.8745
959 7ZE 0.8741
960 DOR 0.8740
961 273 0.8739
962 HUI 0.8738
963 HZP 0.8738
964 NTZ 0.8732
965 9X7 0.8729
966 XIY 0.8728
967 DHK 0.8727
968 0FN 0.8726
969 MWP 0.8724
970 FHN 0.8722
971 ODV 0.8722
972 SS1 0.8721
973 CP 0.8721
974 JZ5 0.8719
975 LT2 0.8714
976 K5W 0.8712
977 3FH 0.8711
978 INE 0.8705
979 X05 0.8704
980 ORO 0.8702
981 GOX 0.8700
982 FAC 0.8697
983 SNE 0.8695
984 FQI 0.8695
985 CLZ 0.8692
986 PZI 0.8691
987 IUP 0.8691
988 AMG 0.8689
989 CHT 0.8689
990 GLN 0.8688
991 GTR 0.8688
992 6JN 0.8687
993 8EW 0.8683
994 NIZ 0.8683
995 B62 0.8681
996 D1X 0.8673
997 4JQ 0.8672
998 3PF 0.8670
999 ADA 0.8669
1000 173 0.8668
1001 ICO 0.8665
1002 ADM 0.8665
1003 BNT 0.8664
1004 SKM 0.8660
1005 06B 0.8659
1006 9RW 0.8648
1007 8WO 0.8647
1008 ENL 0.8645
1009 GIM 0.8643
1010 IPM 0.8635
1011 1DU 0.8634
1012 GDE 0.8632
1013 AEZ 0.8631
1014 LDP 0.8629
1015 RMN 0.8628
1016 COI 0.8627
1017 4NG 0.8624
1018 AKG 0.8622
1019 3PG 0.8622
1020 AI2 0.8620
1021 HCS 0.8617
1022 SXS 0.8614
1023 C2N 0.8609
1024 SOR 0.8609
1025 23J 0.8607
1026 1DJ 0.8606
1027 KBB 0.8605
1028 7N0 0.8602
1029 BNZ 0.8600
1030 DCY 0.8595
1031 DQU 0.8592
1032 2BG 0.8592
1033 GTZ 0.8590
1034 UGC 0.8590
1035 3MB 0.8589
1036 QSH 0.8588
1037 MVL 0.8586
1038 HLT 0.8581
1039 51R 0.8577
1040 4P0 0.8574
1041 CXF 0.8573
1042 MNN 0.8573
1043 IFP 0.8569
1044 TAY 0.8561
1045 HVQ 0.8561
1046 PHZ 0.8560
1047 P2D 0.8558
1048 4XV 0.8545
1049 0PY 0.8540
1050 AOS 0.8537
1051 ICN 0.8536
1052 AMT 0.8530
1053 KFH 0.8529
1054 PEL 0.8526
1055 3MT 0.8520
1056 HTP 0.8518
1057 QX4 0.8516
1058 MET 0.8513
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 1B3X; Ligand: XYP XYP XYP; Similar sites found with APoc: 1
This union binding pocket(no: 1) in the query (biounit: 1b3x.bio1) has 17 residues
No: Leader PDB Ligand Sequence Similarity
1 4PMZ XYP XYP 37.7483
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