Receptor
PDB id Resolution Class Description Source Keywords
2UY3 1.9 Å EC: 3.2.1.14 SCCTS1_8-CHLOROTHEOPHYLLINE CRYSTAL STRUCTURE SACCHAROMYCES CEREVISIAE CARBOHYDRATE METABOLISM POLYSACCHARIDE DEGRADATION GLYCOPRCHITIN-BINDING CHITIN DEGRADATION CAZY HYDROLASE GLYCOS
Ref.: STRUCTURE OF SACCHAROMYCES CEREVISIAE CHITINASE 1 A SCREENING-BASED DISCOVERY OF POTENT INHIBITORS. CHEM.BIOL. V. 14 589 2007
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
H33 A:1311;
 Valid;
 none;
 Ki = 600 uM
214.609 C7 H7 Cl N4 O2 CN1c2...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
4TXE 1.8 Å EC: 3.2.1.14 SCCTS1 IN COMPLEX WITH COMPOUND 5 SACCHAROMYCES CEREVISIAE CHITINASE PLANT-TYPE INHIBITOR HYDROLASE
Ref.: SCREENING-BASED DISCOVERY OF ASPERGILLUS FUMIGATUS PLANT-TYPE CHITINASE INHIBITORS FEBS LETT V. 588 3282 2014
Members (4)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 22 families.
1 2UY4 Ki = 21 uM AZM C4 H6 N4 O3 S2 CC(=O)Nc1n....
2 4TXE ic50 = 2.4 uM 38F C20 H25 N O2 Cc1ccc(cc1....
3 2UY3 Ki = 600 uM H33 C7 H7 Cl N4 O2 CN1c2c([nH....
4 2UY5 Ki = 3.2 uM H35 C10 H9 N5 O c1cc(oc1)C....
70% Homology Family (4)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 20 families.
1 2UY4 Ki = 21 uM AZM C4 H6 N4 O3 S2 CC(=O)Nc1n....
2 4TXE ic50 = 2.4 uM 38F C20 H25 N O2 Cc1ccc(cc1....
3 2UY3 Ki = 600 uM H33 C7 H7 Cl N4 O2 CN1c2c([nH....
4 2UY5 Ki = 3.2 uM H35 C10 H9 N5 O c1cc(oc1)C....
50% Homology Family (8)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 11 families.
1 4TX6 ic50 = 2.6 uM 38B C13 H11 N3 O3 CC1=Nc2c(c....
2 2XTK ic50 = 164 uM AZM C4 H6 N4 O3 S2 CC(=O)Nc1n....
3 2XVN ic50 = 112 uM KLS C9 H12 N4 O CNC(=O)NC(....
4 2XUC ic50 = 79 uM XRG C4 H10 N4 O [H]/N=C(NC....
5 2UY4 Ki = 21 uM AZM C4 H6 N4 O3 S2 CC(=O)Nc1n....
6 4TXE ic50 = 2.4 uM 38F C20 H25 N O2 Cc1ccc(cc1....
7 2UY3 Ki = 600 uM H33 C7 H7 Cl N4 O2 CN1c2c([nH....
8 2UY5 Ki = 3.2 uM H35 C10 H9 N5 O c1cc(oc1)C....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: H33; Similar ligands found: 1
No: Ligand ECFP6 Tc MDL keys Tc
1 H33 1 1
Similar Ligands (3D)
Ligand no: 1; Ligand: H33; Similar ligands found: 877
No: Ligand Similarity coefficient
1 209 0.9981
2 9KT 0.9746
3 LI6 0.9733
4 BGC 0.9733
5 TEP 0.9729
6 G3F 0.9704
7 8S0 0.9697
8 K22 0.9691
9 K32 0.9686
10 NTZ 0.9591
11 GCS 0.9590
12 B57 0.9550
13 GLC 0.9547
14 VK3 0.9523
15 AZ9 0.9521
16 CFF 0.9519
17 LGC 0.9512
18 NQ 0.9503
19 RXA 0.9500
20 0N7 0.9495
21 2FQ 0.9493
22 URC 0.9483
23 HQD 0.9480
24 NDM 0.9479
25 K17 0.9469
26 TBS 0.9467
27 SHG 0.9466
28 DPZ 0.9464
29 B55 0.9450
30 K3Q 0.9443
31 GAL 0.9440
32 IV2 0.9426
33 XAZ 0.9418
34 APZ 0.9417
35 PFB 0.9413
36 8TX 0.9413
37 K37 0.9406
38 75K 0.9405
39 8IG 0.9405
40 BTY 0.9400
41 GIM 0.9393
42 4ME 0.9391
43 CLZ 0.9387
44 680 0.9381
45 QBK 0.9376
46 BEA 0.9372
47 AEZ 0.9372
48 8XQ 0.9368
49 NOJ 0.9356
50 5JL 0.9356
51 PHH 0.9351
52 6RQ 0.9347
53 A7W 0.9345
54 TTY 0.9342
55 UFO 0.9341
56 MRW 0.9338
57 HTP 0.9338
58 0FO 0.9338
59 12B 0.9328
60 FLV 0.9322
61 5JQ 0.9321
62 PQ0 0.9319
63 UAN 0.9313
64 GCU 0.9309
65 ISE 0.9308
66 3MG 0.9304
67 TTL 0.9299
68 HNQ 0.9296
69 FDB 0.9294
70 5WY 0.9293
71 DIN 0.9291
72 2H5 0.9290
73 226 0.9289
74 PYQ 0.9288
75 JTH 0.9288
76 OTW 0.9287
77 LKA 0.9284
78 4KL 0.9284
79 2ZQ 0.9284
80 QX4 0.9280
81 B60 0.9273
82 PH2 0.9273
83 6VD 0.9268
84 XHP 0.9268
85 3PF 0.9267
86 ZYR 0.9260
87 7ZE 0.9258
88 37T 0.9258
89 12Q 0.9256
90 N8Y 0.9256
91 2D0 0.9255
92 B62 0.9254
93 0P6 0.9252
94 E7S 0.9249
95 DQU 0.9245
96 4AA 0.9243
97 MT0 0.9242
98 7NI 0.9240
99 CWM 0.9232
100 Q6T 0.9231
101 3HA 0.9231
102 MAQ 0.9230
103 MVL 0.9228
104 5WU 0.9225
105 DNC 0.9225
106 HZQ 0.9223
107 PRF 0.9223
108 MEW 0.9222
109 BDP 0.9221
110 5RO 0.9219
111 82I 0.9218
112 CWS 0.9217
113 MVN 0.9215
114 AZ8 0.9211
115 PX7 0.9210
116 DNF 0.9210
117 OA3 0.9210
118 AKH 0.9210
119 3F0 0.9209
120 AJ2 0.9208
121 ES0 0.9207
122 44W 0.9205
123 5QY 0.9205
124 M5K 0.9203
125 495 0.9203
126 2KA 0.9203
127 PE0 0.9202
128 K6X 0.9202
129 MUA 0.9201
130 KUF 0.9200
131 Q88 0.9200
132 5QX 0.9198
133 KT7 0.9198
134 HJP 0.9197
135 Q24 0.9193
136 FOT 0.9193
137 GIO 0.9192
138 8CM 0.9192
139 PXL 0.9190
140 Z5P 0.9190
141 7B3 0.9190
142 NID 0.9190
143 44V 0.9190
144 3IT 0.9188
145 INE 0.9185
146 JUG 0.9182
147 EVA 0.9182
148 RPQ 0.9180
149 8W9 0.9180
150 CTS 0.9178
151 K25 0.9178
152 KJH 0.9177
153 ZVO 0.9175
154 D48 0.9175
155 HQT 0.9175
156 7W1 0.9174
157 VNL 0.9173
158 J9W 0.9172
159 GCB 0.9168
160 QPR 0.9165
161 K8X 0.9164
162 JBQ 0.9164
163 4MU 0.9163
164 8HC 0.9163
165 XAN 0.9162
166 X8D 0.9159
167 G3E 0.9159
168 TOF 0.9157
169 97T 0.9156
170 DMD 0.9152
171 G1O 0.9151
172 SE2 0.9150
173 AQO 0.9150
174 SYV 0.9145
175 9DG 0.9145
176 7VJ 0.9145
177 EA1 0.9141
178 4HC 0.9141
179 AZA 0.9140
180 J5I 0.9138
181 B53 0.9138
182 GUN 0.9137
183 DBH 0.9136
184 6BL 0.9135
185 9MG 0.9135
186 R9Y 0.9134
187 3ID 0.9134
188 QWW 0.9132
189 4M0 0.9132
190 AJV 0.9131
191 5WX 0.9131
192 39A 0.9131
193 JG8 0.9129
194 6ME 0.9128
195 JU2 0.9127
196 JR2 0.9127
197 J9Q 0.9127
198 IJZ 0.9123
199 8WT 0.9122
200 92K 0.9120
201 2LY 0.9119
202 1X7 0.9118
203 GLA 0.9118
204 PRZ 0.9118
205 2AK 0.9116
206 2EC 0.9115
207 M1Q 0.9115
208 BPU 0.9113
209 G2F 0.9113
210 3Z8 0.9112
211 INS 0.9112
212 BSP 0.9111
213 PEY 0.9109
214 42C 0.9108
215 EMZ 0.9108
216 3WA 0.9108
217 QX2 0.9106
218 M6N 0.9105
219 DRL 0.9104
220 IGA 0.9104
221 SOE 0.9103
222 JBK 0.9102
223 F12 0.9101
224 7VS 0.9098
225 DHK 0.9097
226 67N 0.9092
227 15L 0.9092
228 92P 0.9091
229 GTZ 0.9091
230 SKA 0.9089
231 GDE 0.9089
232 FA0 0.9088
233 HKD 0.9087
234 EJZ 0.9084
235 141 0.9084
236 X05 0.9082
237 3M0 0.9080
238 AY4 0.9080
239 E1K 0.9080
240 GRE 0.9080
241 7WR 0.9078
242 CFP 0.9075
243 FE DB1 0.9073
244 SOR 0.9073
245 KJY 0.9071
246 GIV 0.9070
247 8ZE 0.9069
248 F1A 0.9069
249 AZG 0.9067
250 5CU 0.9066
251 A2F 0.9065
252 LDR 0.9064
253 C2U 0.9062
254 AA 0.9062
255 FBG 0.9061
256 0FK 0.9061
257 GTR 0.9061
258 FDR 0.9060
259 537 0.9059
260 N3W 0.9059
261 MS9 0.9058
262 ET2 0.9057
263 BMA 0.9056
264 MT5 0.9055
265 6M1 0.9055
266 YH7 0.9054
267 GZL 0.9053
268 1XM 0.9052
269 C2Y 0.9052
270 5RN 0.9051
271 6AP 0.9048
272 BHA 0.9047
273 5Q0 0.9047
274 G1P 0.9046
275 DOB 0.9046
276 7MX 0.9045
277 TSS 0.9043
278 5NU 0.9042
279 YSO 0.9042
280 2D3 0.9041
281 9AP 0.9040
282 HHA 0.9040
283 D07 0.9040
284 SYA 0.9039
285 NAG 0.9037
286 ZZ8 0.9036
287 HQY 0.9035
288 G5V 0.9035
289 H5B 0.9035
290 GI3 0.9034
291 CLW 0.9034
292 15E 0.9034
293 ASO 0.9030
294 6F0 0.9029
295 293 0.9029
296 2K8 0.9028
297 KIB 0.9028
298 5SG 0.9026
299 DQN 0.9026
300 PCI 0.9025
301 MO8 0.9024
302 IBM 0.9023
303 4RU 0.9023
304 5VM 0.9022
305 AIN 0.9022
306 9R5 0.9022
307 QWN 0.9021
308 M2K 0.9020
309 23A 0.9019
310 03V 0.9019
311 HHR 0.9019
312 290 0.9019
313 M1A 0.9018
314 ICO 0.9018
315 ANF 0.9018
316 1NP 0.9016
317 G12 0.9015
318 8NX 0.9014
319 BOA 0.9014
320 N5J 0.9013
321 R8V 0.9013
322 DX4 0.9011
323 6GU 0.9010
324 DIU 0.9009
325 1P8 0.9007
326 C9E 0.9006
327 XQ0 0.9005
328 ES1 0.9004
329 BPY 0.9003
330 ES2 0.9002
331 0CU 0.9002
332 UNC 0.9000
333 9FL 0.9000
334 MBG 0.9000
335 PXM 0.8999
336 M0W 0.8999
337 28N 0.8999
338 GOX 0.8998
339 VGD 0.8998
340 KIA 0.8998
341 SHA 0.8997
342 32X 0.8997
343 24W 0.8997
344 SXS 0.8996
345 5IQ 0.8996
346 4AN 0.8996
347 VXX 0.8995
348 X0W 0.8994
349 1KP 0.8994
350 KIF 0.8993
351 V1T 0.8992
352 2JK 0.8992
353 O72 0.8990
354 149 0.8990
355 582 0.8989
356 1SQ 0.8986
357 4YS 0.8985
358 7I2 0.8984
359 NDG 0.8983
360 KJU 0.8982
361 54X 0.8982
362 4TU 0.8981
363 36R 0.8980
364 UEG 0.8980
365 2ZV 0.8979
366 4XV 0.8979
367 3FH 0.8978
368 1LQ 0.8977
369 1LM 0.8976
370 1GN 0.8976
371 5NE 0.8974
372 4FS 0.8973
373 KDV 0.8973
374 ADZ 0.8972
375 GNM 0.8971
376 8GK 0.8971
377 I6G 0.8970
378 Q71 0.8969
379 DRG 0.8967
380 JPZ 0.8967
381 2HQ 0.8966
382 7HQ 0.8965
383 COU 0.8965
384 B56 0.8963
385 ADK 0.8960
386 1HN 0.8958
387 JBH 0.8958
388 M1E 0.8957
389 GJP 0.8957
390 TWO 0.8956
391 ES5 0.8955
392 HFB 0.8954
393 DHB 0.8953
394 GM7 0.8951
395 GJS 0.8951
396 3RI 0.8949
397 QAT 0.8949
398 15N 0.8949
399 HLZ 0.8948
400 N2I 0.8948
401 DK1 0.8948
402 M4E 0.8948
403 4XS 0.8946
404 7ME 0.8946
405 3DM 0.8945
406 F3B 0.8945
407 GTQ 0.8943
408 I3A 0.8943
409 BNT 0.8942
410 V55 0.8942
411 2AQ 0.8941
412 ADA 0.8940
413 0F9 0.8940
414 FBB 0.8940
415 TIY 0.8938
416 2FG 0.8937
417 BK9 0.8936
418 GV9 0.8936
419 ODO 0.8936
420 20J 0.8935
421 18N 0.8935
422 KBG 0.8935
423 3J8 0.8935
424 BCP 0.8933
425 CWJ 0.8931
426 HBO 0.8930
427 CH9 0.8929
428 GF4 0.8927
429 06B 0.8926
430 QXW 0.8925
431 7B4 0.8925
432 K2T 0.8925
433 QAS 0.8925
434 H42 0.8924
435 86J 0.8923
436 NGO 0.8922
437 9CA 0.8921
438 8MO 0.8921
439 THA 0.8920
440 DBJ 0.8920
441 1QV 0.8920
442 OCH 0.8918
443 GZ8 0.8918
444 4HM 0.8918
445 1U1 0.8917
446 HH5 0.8917
447 39U 0.8917
448 XXP 0.8916
449 DNA 0.8916
450 52C 0.8915
451 5XC 0.8914
452 LZM 0.8914
453 J6W 0.8914
454 XQG 0.8913
455 XQK 0.8913
456 XFE 0.8912
457 DHQ 0.8912
458 4NC 0.8911
459 JKZ 0.8910
460 INO 0.8909
461 HIS 0.8908
462 M0Q 0.8908
463 MQN 0.8906
464 3QV 0.8906
465 Q77 0.8906
466 ONR 0.8905
467 F0J 0.8905
468 57O 0.8904
469 MAN 0.8903
470 JND 0.8903
471 ZB1 0.8901
472 SWA 0.8901
473 5NS 0.8901
474 3MA 0.8900
475 SKM 0.8897
476 RM1 0.8896
477 PJW 0.8896
478 B5D 0.8896
479 4JQ 0.8896
480 344 0.8896
481 GAF 0.8894
482 TQU 0.8893
483 CN0 0.8892
484 0JD 0.8892
485 X6X 0.8892
486 SYR 0.8892
487 EQT 0.8891
488 GCW 0.8890
489 K44 0.8890
490 LT2 0.8890
491 FGZ 0.8889
492 OMD 0.8888
493 KG1 0.8887
494 CTL 0.8887
495 P3K 0.8887
496 0HO 0.8885
497 G6D 0.8885
498 IBF 0.8883
499 42A 0.8883
500 GSY 0.8883
501 25W 0.8882
502 GXL 0.8882
503 2FY 0.8882
504 0TU 0.8881
505 LDP 0.8880
506 KFH 0.8880
507 AJY 0.8880
508 3GQ 0.8880
509 HH8 0.8879
510 6CS 0.8877
511 FH2 0.8875
512 1IT 0.8874
513 N7I 0.8874
514 5WV 0.8873
515 12T 0.8872
516 5GU 0.8872
517 WOO 0.8872
518 HHS 0.8871
519 P9P 0.8871
520 QSH 0.8869
521 ISN 0.8869
522 F31 0.8869
523 NNO 0.8868
524 MT8 0.8868
525 ESI 0.8867
526 27B 0.8866
527 PDC 0.8866
528 54G 0.8866
529 FDK 0.8863
530 8WO 0.8863
531 4XH 0.8862
532 DEE 0.8861
533 0FN 0.8860
534 39O 0.8860
535 JA8 0.8860
536 NDH 0.8860
537 FHB 0.8858
538 4A3 0.8858
539 AHR 0.8857
540 CKA 0.8853
541 68A 0.8852
542 X09 0.8852
543 AX7 0.8852
544 5OB 0.8852
545 KGK 0.8851
546 JP2 0.8851
547 L7T 0.8851
548 5M0 0.8851
549 93K 0.8850
550 MIG 0.8849
551 GHM 0.8848
552 XIY 0.8848
553 E7Z 0.8847
554 ALL 0.8847
555 SX1 0.8846
556 1M2 0.8846
557 270 0.8845
558 E1T 0.8844
559 6NT 0.8844
560 0HN 0.8843
561 MXX 0.8840
562 M1H 0.8839
563 64C 0.8837
564 261 0.8837
565 AN3 0.8836
566 6QF 0.8835
567 2AL 0.8834
568 JLZ 0.8834
569 3HM 0.8834
570 XX2 0.8834
571 J9T 0.8833
572 BZ3 0.8832
573 5RG 0.8831
574 3RK 0.8831
575 P92 0.8830
576 FBT 0.8829
577 KKN 0.8829
578 1XA 0.8828
579 AMG 0.8827
580 GOG 0.8826
581 4M4 0.8826
582 BTE 0.8825
583 2ZM 0.8825
584 KTW 0.8825
585 BE2 0.8824
586 F2W 0.8823
587 MYJ 0.8822
588 IFL 0.8822
589 K5W 0.8820
590 7W4 0.8820
591 EV0 0.8820
592 GLT 0.8820
593 BZJ 0.8819
594 GDL 0.8819
595 94W 0.8817
596 4YO 0.8817
597 NOY 0.8817
598 SRO 0.8816
599 2HU 0.8815
600 HPA 0.8814
601 X0U 0.8813
602 F5C 0.8813
603 HQJ 0.8810
604 SAL 0.8809
605 EUG 0.8809
606 2MI 0.8808
607 BCF 0.8808
608 AX3 0.8808
609 FP1 0.8807
610 6XI 0.8807
611 1F1 0.8806
612 BBF 0.8805
613 F9Y 0.8803
614 3NY 0.8802
615 329 0.8801
616 30G 0.8801
617 8WZ 0.8798
618 NVU 0.8798
619 10L 0.8797
620 2HO 0.8794
621 XM5 0.8793
622 HA5 0.8793
623 EN1 0.8791
624 ZWZ 0.8791
625 4Z4 0.8790
626 3A9 0.8789
627 7FF 0.8787
628 F5B 0.8787
629 FA3 0.8786
630 6MP 0.8786
631 1P7 0.8786
632 Q7A 0.8784
633 0W8 0.8784
634 W81 0.8784
635 A29 0.8783
636 3R6 0.8782
637 5TY 0.8782
638 KLK 0.8781
639 9ZE 0.8780
640 ABV 0.8780
641 ES7 0.8778
642 APS 0.8778
643 2CZ 0.8778
644 FYU 0.8777
645 1X8 0.8776
646 5NI 0.8776
647 LZ2 0.8775
648 JB5 0.8775
649 BA5 0.8775
650 4SV 0.8775
651 LIP 0.8774
652 CHB 0.8774
653 HLD 0.8774
654 ADE 0.8773
655 CKX 0.8772
656 L46 0.8770
657 7D2 0.8770
658 ANC 0.8770
659 IPB 0.8770
660 F81 0.8768
661 5OF 0.8768
662 GCV 0.8768
663 BZX 0.8768
664 2F6 0.8768
665 ABI 0.8764
666 KYD 0.8762
667 ARP 0.8761
668 5MK 0.8754
669 428 0.8754
670 BDF 0.8754
671 NBG 0.8753
672 7HP 0.8753
673 6NI 0.8752
674 KJ5 0.8752
675 PHT 0.8751
676 3Y7 0.8750
677 OXC 0.8749
678 BP1 0.8748
679 9TZ 0.8747
680 1DW 0.8747
681 TT4 0.8746
682 KOJ 0.8746
683 9TW 0.8743
684 CKU 0.8739
685 QSB 0.8739
686 TNF 0.8738
687 1U6 0.8738
688 9LI 0.8736
689 2BG 0.8736
690 JIF 0.8736
691 YQA 0.8736
692 9PY 0.8735
693 TH7 0.8735
694 GCO 0.8734
695 S76 0.8733
696 HMH 0.8730
697 ORO 0.8730
698 7WA 0.8730
699 M6Z 0.8729
700 1A7 0.8729
701 MZB 0.8729
702 H6B 0.8728
703 JKE 0.8726
704 NBV 0.8725
705 ES6 0.8725
706 1QP 0.8725
707 069 0.8723
708 7MU 0.8722
709 N2Z 0.8722
710 67X 0.8722
711 5VL 0.8721
712 BZ2 0.8721
713 14O 0.8721
714 3C1 0.8720
715 DMJ 0.8720
716 4JT 0.8720
717 DGJ 0.8720
718 4V6 0.8720
719 SWD 0.8720
720 EGR 0.8719
721 3U4 0.8718
722 1XN 0.8718
723 NTM 0.8718
724 9HX 0.8715
725 9DA 0.8715
726 JF2 0.8714
727 6AI 0.8714
728 ZZZ 0.8713
729 L5V 0.8712
730 0GZ 0.8711
731 IHB 0.8709
732 GYE 0.8709
733 SVN 0.8709
734 4BY 0.8708
735 0XT 0.8708
736 3TJ 0.8707
737 5VJ 0.8707
738 TXW 0.8705
739 FUD 0.8705
740 QMS 0.8704
741 X0V 0.8704
742 2K4 0.8703
743 5H1 0.8703
744 EXD 0.8703
745 IAC 0.8703
746 505 0.8700
747 ESP 0.8699
748 NPY 0.8698
749 ES4 0.8696
750 F60 0.8695
751 60Q 0.8694
752 MHK 0.8694
753 7WV 0.8694
754 TGX 0.8692
755 NGT 0.8689
756 UQ 0.8689
757 0W1 0.8685
758 QUZ 0.8685
759 55D 0.8685
760 3HB 0.8685
761 DOR 0.8682
762 GT0 0.8681
763 D1X 0.8681
764 2A9 0.8680
765 49O 0.8680
766 FA6 0.8680
767 LT8 0.8679
768 DPT 0.8679
769 5MB 0.8678
770 UFV 0.8678
771 MFU 0.8676
772 6KT 0.8676
773 MR1 0.8676
774 L99 0.8676
775 I4D 0.8675
776 MWP 0.8674
777 GXY 0.8673
778 XXR 0.8673
779 PM6 0.8671
780 5B1 0.8671
781 5MI 0.8671
782 NLA 0.8670
783 4BL 0.8670
784 LNR 0.8668
785 T6C 0.8668
786 GNV 0.8667
787 LAO 0.8666
788 SQ4 0.8664
789 JF1 0.8663
790 GI1 0.8663
791 EKZ 0.8663
792 GTL 0.8663
793 7MH 0.8660
794 ROI 0.8660
795 ES9 0.8660
796 MMA 0.8660
797 JYB 0.8659
798 EXO 0.8657
799 DX3 0.8654
800 R6T 0.8653
801 YIO 0.8652
802 1WD 0.8652
803 ASC 0.8652
804 BGU 0.8651
805 3C2 0.8650
806 S60 0.8649
807 VOH 0.8648
808 JFD 0.8648
809 11S 0.8648
810 IFP 0.8646
811 HMU 0.8642
812 ICB 0.8642
813 H7Y 0.8640
814 4VS 0.8640
815 SG2 0.8640
816 ZZT 0.8639
817 HXX 0.8638
818 FK1 0.8637
819 9FE 0.8636
820 GAB 0.8635
821 N0Z 0.8634
822 3AB 0.8633
823 IF7 0.8633
824 JDN 0.8628
825 H4N 0.8628
826 6M9 0.8627
827 PA1 0.8624
828 F69 0.8624
829 NIZ 0.8623
830 34D 0.8623
831 SQ7 0.8621
832 4FH 0.8614
833 173 0.8613
834 JAE 0.8612
835 HPT 0.8611
836 6X9 0.8610
837 A1Y 0.8610
838 3NT 0.8607
839 6R8 0.8605
840 64E 0.8604
841 QIC 0.8603
842 5HN 0.8602
843 KYA 0.8601
844 3ZB 0.8600
845 AW5 0.8599
846 UXH 0.8596
847 UNJ 0.8592
848 LYL 0.8590
849 AMR 0.8589
850 E7R 0.8588
851 BIK 0.8586
852 JAW 0.8585
853 9EW 0.8584
854 8XL 0.8581
855 TFU 0.8581
856 A13 0.8581
857 ITE 0.8578
858 LSA 0.8575
859 KLW 0.8570
860 DIE 0.8568
861 GNL 0.8568
862 OVV 0.8566
863 MOK 0.8564
864 DQA 0.8563
865 23J 0.8561
866 BDI 0.8558
867 NSG 0.8550
868 4P5 0.8547
869 8NY 0.8541
870 FHN 0.8536
871 2GS 0.8535
872 2CK 0.8533
873 6DP 0.8530
874 2HC 0.8530
875 PD2 0.8527
876 AEH 0.8523
877 ESX 0.8513
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 4TXE; Ligand: 38F; 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: 4txe.bio1) has 19 residues
No: Leader PDB Ligand Sequence Similarity
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