Receptor
PDB id Resolution Class Description Source Keywords
3ST6 1.75 Å EC: 4.1.3.- STRUCTURE OF A M. TUBERCULOSIS SYNTHASE, MBTI, IN COMPLEX WI ISOCHORISMATE ANALOGUE INHIBITOR MYCOBACTERIUM TUBERCULOSIS STRUCTURAL GENOMICS TB STRUCTURAL GENOMICS CONSORTIUM TBSGALPHA/BETA FOLD SALICYLATE SYNTHASE CHORISMATE BINDING IISOMERASE INHIBITOR COMPLEX
Ref.: IMPLICATIONS OF BINDING MODE AND ACTIVE SITE FLEXIB INHIBITOR POTENCY AGAINST THE SALICYLATE SYNTHASE F MYCOBACTERIUM TUBERCULOSIS BIOCHEMISTRY V. 51 4868 2012
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
RVE A:451;
B:451;
 Valid;
Valid;
 none;
none;
 Ki = 240 uM
224.167 C10 H8 O6 C=C(C...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
6ZA4 2.09 Å EC: 4.1.3.- M. TUBERCULOSIS SALICYLATE SYNTHASE MBTI IN COMPLEX WITH 5-( CYANOPHENYL)FURAN-2-CARBOXYLATE MYCOBACTERIUM TUBERCULOSIS (STRAIN ATCH37RV) SALICYLATE ISOCHORISMATE CHORISMATE MYCOBACTINS LYASE
Ref.: SHEDDING X-RAY LIGHT ON THE ROLE OF MAGNESIUM IN TH ACTIVITY OFMYCOBACTERIUM TUBERCULOSISSALICYLATE SYN (MBTI) FOR DRUG DESIGN. J.MED.CHEM. V. 63 7066 2020
Members (10)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 5 families.
1 3ST6 Ki = 240 uM RVE C10 H8 O6 C=C(C(=O)O....
2 6ZA4 ic50 = 6.3 uM M83 C12 H7 N O3 c1cc(cc(c1....
3 3RV6 Ki = 21 uM RVA C16 H12 O6 c1ccc(cc1)....
4 3RV9 Ki = 12 uM RVD C12 H12 O6 CC/C=C(/C(....
5 3RV7 Ki = 14 uM RVB C13 H14 O6 CC(C)/C=C(....
6 2G5F - PYR C3 H4 O3 CC(=O)C(=O....
7 3VEH Ki = 11 uM 0GA C11 H10 O6 C/C=C(/C(=....
8 6ZA5 - SAL C7 H6 O3 c1ccc(c(c1....
9 3LOG - SIN C4 H6 O4 C(CC(=O)O)....
10 3RV8 Ki = 12 uM RVC C13 H12 O6 c1cc(c(c(c....
70% Homology Family (10)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 5 families.
1 3ST6 Ki = 240 uM RVE C10 H8 O6 C=C(C(=O)O....
2 6ZA4 ic50 = 6.3 uM M83 C12 H7 N O3 c1cc(cc(c1....
3 3RV6 Ki = 21 uM RVA C16 H12 O6 c1ccc(cc1)....
4 3RV9 Ki = 12 uM RVD C12 H12 O6 CC/C=C(/C(....
5 3RV7 Ki = 14 uM RVB C13 H14 O6 CC(C)/C=C(....
6 2G5F - PYR C3 H4 O3 CC(=O)C(=O....
7 3VEH Ki = 11 uM 0GA C11 H10 O6 C/C=C(/C(=....
8 6ZA5 - SAL C7 H6 O3 c1ccc(c(c1....
9 3LOG - SIN C4 H6 O4 C(CC(=O)O)....
10 3RV8 Ki = 12 uM RVC C13 H12 O6 c1cc(c(c(c....
50% Homology Family (11)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 4 families.
1 2FN1 - PYR C3 H4 O3 CC(=O)C(=O....
2 3ST6 Ki = 240 uM RVE C10 H8 O6 C=C(C(=O)O....
3 6ZA4 ic50 = 6.3 uM M83 C12 H7 N O3 c1cc(cc(c1....
4 3RV6 Ki = 21 uM RVA C16 H12 O6 c1ccc(cc1)....
5 3RV9 Ki = 12 uM RVD C12 H12 O6 CC/C=C(/C(....
6 3RV7 Ki = 14 uM RVB C13 H14 O6 CC(C)/C=C(....
7 2G5F - PYR C3 H4 O3 CC(=O)C(=O....
8 3VEH Ki = 11 uM 0GA C11 H10 O6 C/C=C(/C(=....
9 6ZA5 - SAL C7 H6 O3 c1ccc(c(c1....
10 3LOG - SIN C4 H6 O4 C(CC(=O)O)....
11 3RV8 Ki = 12 uM RVC C13 H12 O6 c1cc(c(c(c....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: RVE; Similar ligands found: 9
No: Ligand ECFP6 Tc MDL keys Tc
1 RVE 1 1
2 0GA 0.5625 0.866667
3 RVD 0.56 0.787879
4 VAE 0.528302 0.83871
5 RVA 0.528302 0.83871
6 RVB 0.519231 0.8125
7 RVC 0.5 0.83871
8 VCE 0.5 0.83871
9 DBH 0.418605 0.733333
Similar Ligands (3D)
Ligand no: 1; Ligand: RVE; Similar ligands found: 841
No: Ligand Similarity coefficient
1 TRP 0.9634
2 DTR 0.9564
3 EXR 0.9557
4 3IL 0.9520
5 0LO 0.9519
6 5F8 0.9516
7 5FL 0.9515
8 AVA 0.9509
9 C0W 0.9487
10 96Z 0.9484
11 NAL 0.9472
12 7L4 0.9449
13 VM1 0.9447
14 2GQ 0.9444
15 ITW 0.9443
16 IOP 0.9417
17 4Z9 0.9402
18 ALN 0.9388
19 P4L 0.9373
20 WVV 0.9359
21 F40 0.9356
22 5B2 0.9346
23 LL1 0.9343
24 3EB 0.9343
25 4OG 0.9342
26 CTE 0.9338
27 KWB 0.9337
28 DXK 0.9335
29 NIY 0.9335
30 5F5 0.9321
31 B41 0.9321
32 RKV 0.9319
33 JSX 0.9319
34 S1D 0.9319
35 X6P 0.9316
36 VBC 0.9312
37 HH6 0.9312
38 FWD 0.9305
39 Q4G 0.9303
40 AUV 0.9303
41 EXL 0.9302
42 CC5 0.9302
43 5E5 0.9295
44 9BF 0.9293
45 9CE 0.9292
46 IQQ 0.9287
47 2D2 0.9281
48 A6W 0.9272
49 BY5 0.9272
50 6J9 0.9260
51 4FF 0.9256
52 363 0.9250
53 0DF 0.9247
54 PIQ 0.9246
55 LFQ 0.9245
56 5V7 0.9242
57 790 0.9242
58 II4 0.9240
59 H7S 0.9238
60 3AK 0.9233
61 3Y7 0.9233
62 L5D 0.9226
63 1SF 0.9225
64 5P3 0.9225
65 EYY 0.9224
66 H2B 0.9217
67 49P 0.9217
68 S3C 0.9213
69 78U 0.9210
70 LTN 0.9207
71 3GX 0.9205
72 5AD 0.9205
73 CWD 0.9203
74 9UL 0.9196
75 272 0.9195
76 BWD 0.9195
77 JCZ 0.9193
78 PW1 0.9191
79 0A1 0.9190
80 52F 0.9187
81 5NN 0.9187
82 ZIQ 0.9186
83 1V1 0.9184
84 A73 0.9183
85 FTV 0.9183
86 1V4 0.9182
87 M3Q 0.9181
88 PYU 0.9175
89 Q0K 0.9173
90 H4B 0.9173
91 0UL 0.9172
92 BIO 0.9170
93 DTE 0.9170
94 HBI 0.9169
95 XEN 0.9168
96 IWD 0.9168
97 I2E 0.9167
98 1V3 0.9166
99 CUT 0.9163
100 7I2 0.9159
101 Q5M 0.9157
102 6DQ 0.9156
103 1ER 0.9155
104 0OK 0.9152
105 BB4 0.9152
106 EYA 0.9151
107 ETV 0.9146
108 9F8 0.9146
109 B2T 0.9145
110 C4E 0.9144
111 4GP 0.9144
112 AVX 0.9143
113 YOF 0.9139
114 LP8 0.9135
115 0J4 0.9135
116 9FH 0.9134
117 20D 0.9133
118 EV2 0.9133
119 NIR 0.9132
120 LTT 0.9131
121 DAH 0.9130
122 B5A 0.9130
123 FNA 0.9129
124 MMS 0.9129
125 96R 0.9127
126 FT6 0.9118
127 BZM 0.9117
128 HWD 0.9115
129 8MP 0.9114
130 KF5 0.9114
131 3TC 0.9113
132 EUH 0.9111
133 TCC 0.9110
134 TSR 0.9109
135 2LT 0.9108
136 54X 0.9104
137 3WJ 0.9101
138 EWG 0.9098
139 NYJ 0.9097
140 5WN 0.9096
141 2P3 0.9096
142 ZZA 0.9095
143 IAC 0.9095
144 8D6 0.9093
145 MUR 0.9093
146 HA6 0.9092
147 LWS 0.9092
148 LEL 0.9092
149 833 0.9089
150 YE7 0.9089
151 5TZ 0.9089
152 CHQ 0.9088
153 ZME 0.9085
154 DDC 0.9084
155 28A 0.9083
156 9GP 0.9081
157 JY2 0.9080
158 MEX 0.9079
159 5JT 0.9077
160 IOS 0.9076
161 7FF 0.9075
162 KYN 0.9073
163 EYJ 0.9073
164 CR1 0.9072
165 AMR 0.9072
166 GNV 0.9070
167 FCD 0.9070
168 KW7 0.9069
169 CX4 0.9068
170 2UD 0.9068
171 PLP 0.9067
172 2JX 0.9067
173 BGN 0.9067
174 U4J 0.9066
175 TQU 0.9065
176 S0G 0.9064
177 1A5 0.9064
178 CSN 0.9063
179 1FL 0.9060
180 5VU 0.9059
181 AZY 0.9058
182 BPY 0.9056
183 3SU 0.9055
184 54E 0.9055
185 QUB 0.9053
186 JFS 0.9051
187 NAG 0.9051
188 SYE 0.9050
189 TYR 0.9049
190 TR7 0.9048
191 W8G 0.9047
192 G14 0.9046
193 P9I 0.9045
194 0K7 0.9042
195 1FE 0.9040
196 CUH 0.9038
197 ZON 0.9037
198 SSY 0.9037
199 AED 0.9036
200 8DA 0.9036
201 2L1 0.9035
202 7AP 0.9034
203 AOJ 0.9033
204 M02 0.9033
205 WLH 0.9033
206 3VQ 0.9032
207 YE6 0.9030
208 PZ8 0.9020
209 KP2 0.9017
210 VYM 0.9015
211 ODK 0.9014
212 IYR 0.9013
213 Z25 0.9012
214 F52 0.9011
215 92O 0.9010
216 M5H 0.9009
217 JP2 0.9008
218 XI7 0.9007
219 A9B 0.9006
220 E9L 0.9006
221 JYW 0.9006
222 3F4 0.9005
223 3CA 0.9005
224 5WT 0.9005
225 BP3 0.9004
226 EAJ 0.9003
227 SZ5 0.9002
228 JO5 0.9002
229 1Q4 0.9001
230 RGK 0.9000
231 AJD 0.9000
232 THM 0.8997
233 NWD 0.8997
234 ZEA 0.8997
235 TYC 0.8997
236 JBZ 0.8993
237 6HP 0.8993
238 8NX 0.8991
239 BXZ 0.8991
240 6GP 0.8991
241 PFF 0.8989
242 TNX 0.8988
243 LR2 0.8987
244 X04 0.8987
245 4CF 0.8983
246 PMP 0.8982
247 QMS 0.8982
248 RK4 0.8982
249 1X8 0.8981
250 1OS 0.8981
251 FMQ 0.8980
252 9KZ 0.8979
253 MJ5 0.8979
254 SBK 0.8979
255 NKI 0.8979
256 2K8 0.8978
257 EXG 0.8978
258 H2W 0.8978
259 AKD 0.8978
260 3IB 0.8975
261 4AF 0.8975
262 DFL 0.8974
263 DHC 0.8971
264 JTA 0.8971
265 3C5 0.8970
266 CDJ 0.8970
267 1HP 0.8970
268 Y0V 0.8970
269 C2Y 0.8969
270 4NP 0.8967
271 HVE 0.8967
272 3B4 0.8967
273 W8L 0.8967
274 GNY 0.8966
275 4GU 0.8964
276 ZRK 0.8964
277 14W 0.8963
278 SQV 0.8963
279 EVO 0.8963
280 4FE 0.8963
281 HO6 0.8962
282 25F 0.8962
283 XEV 0.8962
284 78Y 0.8962
285 A7Q 0.8961
286 9JT 0.8961
287 CH8 0.8960
288 M01 0.8957
289 3JM 0.8957
290 F5C 0.8956
291 4ZF 0.8955
292 U7E 0.8955
293 4AB 0.8955
294 CG 0.8954
295 KLE 0.8954
296 FCW 0.8954
297 QKU 0.8952
298 8GK 0.8951
299 NTF 0.8949
300 C93 0.8949
301 2JK 0.8949
302 6J5 0.8948
303 38B 0.8948
304 F1X 0.8947
305 7ZL 0.8947
306 VT3 0.8947
307 TI7 0.8947
308 NPA 0.8946
309 4I8 0.8946
310 1QP 0.8944
311 DTY 0.8943
312 7EH 0.8943
313 3D8 0.8943
314 SJK 0.8943
315 W81 0.8940
316 HJH 0.8940
317 22L 0.8938
318 L3L 0.8937
319 6EL 0.8937
320 HLP 0.8937
321 M3W 0.8936
322 BQ2 0.8936
323 JMG 0.8935
324 BGU 0.8935
325 CFA 0.8935
326 4K2 0.8935
327 67Y 0.8934
328 L21 0.8933
329 GC2 0.8930
330 ZYV 0.8930
331 657 0.8930
332 108 0.8929
333 XFE 0.8929
334 PUE 0.8928
335 WCU 0.8928
336 0SY 0.8927
337 K48 0.8925
338 QIV 0.8925
339 6DP 0.8925
340 MW5 0.8923
341 ISJ 0.8923
342 S60 0.8922
343 549 0.8921
344 EYM 0.8920
345 NDG 0.8918
346 MUX 0.8916
347 NK5 0.8916
348 ARJ 0.8916
349 ENO 0.8914
350 5OO 0.8914
351 3VW 0.8912
352 EQA 0.8911
353 HWH 0.8911
354 AU8 0.8911
355 FPL 0.8910
356 H75 0.8910
357 YX1 0.8908
358 STZ 0.8908
359 KLV 0.8908
360 MP5 0.8906
361 EQW 0.8904
362 JYK 0.8904
363 0FR 0.8904
364 5TO 0.8901
365 5H6 0.8901
366 28S 0.8901
367 3DE 0.8900
368 7N8 0.8898
369 WUB 0.8897
370 FER 0.8897
371 5OF 0.8896
372 GNJ 0.8895
373 VJJ 0.8895
374 MMJ 0.8894
375 B4O 0.8893
376 9B3 0.8893
377 536 0.8892
378 CLU 0.8891
379 X6W 0.8890
380 OW7 0.8889
381 1AJ 0.8889
382 VFM 0.8889
383 5E4 0.8889
384 4NR 0.8887
385 5F1 0.8887
386 TCR 0.8886
387 MBP 0.8885
388 CUQ 0.8883
389 IQW 0.8883
390 4BF 0.8882
391 1QV 0.8882
392 G6P 0.8882
393 L07 0.8881
394 TR4 0.8881
395 GDL 0.8880
396 LLG 0.8879
397 GJK 0.8876
398 89J 0.8876
399 CPW 0.8876
400 H35 0.8875
401 PPN 0.8874
402 78P 0.8874
403 33S 0.8874
404 N1E 0.8873
405 B21 0.8873
406 Q9P 0.8873
407 MNP 0.8872
408 X0T 0.8872
409 LRW 0.8872
410 ST3 0.8872
411 B4L 0.8871
412 AC2 0.8869
413 QME 0.8869
414 2UB 0.8869
415 UN3 0.8868
416 DY5 0.8868
417 V1T 0.8866
418 RQD 0.8864
419 8G6 0.8864
420 9H2 0.8863
421 QR2 0.8863
422 AZC 0.8863
423 C9E 0.8862
424 NEU 0.8862
425 0LH 0.8861
426 OQC 0.8861
427 4AU 0.8861
428 CBE 0.8861
429 ZHA 0.8859
430 MZM 0.8859
431 ZIP 0.8858
432 EV3 0.8858
433 ALE 0.8857
434 MS0 0.8857
435 PVQ 0.8857
436 PXP 0.8856
437 B61 0.8855
438 LI7 0.8853
439 ET0 0.8852
440 FWB 0.8852
441 I59 0.8851
442 HHS 0.8851
443 2O8 0.8851
444 GF4 0.8848
445 OUB 0.8848
446 ASE 0.8846
447 BL0 0.8845
448 MDR 0.8845
449 P93 0.8843
450 PH3 0.8842
451 TRF 0.8842
452 PHI 0.8840
453 D2G 0.8840
454 D87 0.8839
455 PF1 0.8839
456 THU 0.8836
457 ERZ 0.8836
458 0OO 0.8835
459 5I5 0.8835
460 6MW 0.8834
461 PVK 0.8833
462 51Y 0.8833
463 SOJ 0.8832
464 K82 0.8831
465 2L2 0.8830
466 NCV 0.8829
467 URI 0.8828
468 TXW 0.8828
469 MPP 0.8828
470 NIF 0.8827
471 3D1 0.8827
472 JYT 0.8825
473 8OE 0.8825
474 1CY 0.8823
475 0ON 0.8823
476 61M 0.8823
477 1ZC 0.8822
478 5ZM 0.8822
479 S0E 0.8822
480 MPU 0.8822
481 4CN 0.8821
482 2WU 0.8821
483 8CC 0.8820
484 P2L 0.8819
485 CGW 0.8819
486 XCG 0.8819
487 APS 0.8819
488 YTX 0.8817
489 3QI 0.8817
490 L1T 0.8817
491 GB4 0.8816
492 344 0.8816
493 D1Y 0.8815
494 S98 0.8815
495 BZE 0.8815
496 57O 0.8814
497 PH2 0.8814
498 DRG 0.8814
499 3WL 0.8814
500 9E3 0.8813
501 0OY 0.8812
502 CMU 0.8811
503 ZSP 0.8809
504 AJ1 0.8806
505 X48 0.8806
506 GZV 0.8805
507 BP7 0.8805
508 FUZ 0.8804
509 8NB 0.8804
510 7MX 0.8803
511 6DE 0.8802
512 42R 0.8802
513 91F 0.8802
514 P0P 0.8801
515 RD4 0.8801
516 27M 0.8800
517 8OB 0.8800
518 RSV 0.8800
519 BHS 0.8800
520 XYP XIF 0.8799
521 9XZ 0.8799
522 Q2S 0.8799
523 ZRL 0.8798
524 5S9 0.8798
525 M78 0.8798
526 BK9 0.8797
527 EUE 0.8796
528 NBG 0.8796
529 6PB 0.8795
530 4AV 0.8795
531 4MB 0.8795
532 CCV 0.8794
533 25O 0.8794
534 XIF XYP 0.8793
535 D1G 0.8792
536 3WN 0.8790
537 3WO 0.8790
538 6TJ 0.8790
539 A7K 0.8790
540 CKA 0.8790
541 J27 0.8789
542 68B 0.8789
543 EY7 0.8789
544 V2Z 0.8789
545 S62 0.8789
546 JXT 0.8788
547 5GT 0.8788
548 2LY 0.8788
549 4E5 0.8787
550 KMY 0.8786
551 3VX 0.8785
552 PLR 0.8785
553 BGP 0.8785
554 0DN 0.8784
555 N7I 0.8783
556 A7H 0.8783
557 E9S 0.8782
558 CK2 0.8782
559 CP6 0.8781
560 MD6 0.8780
561 2UZ 0.8780
562 YZ9 0.8779
563 ZZ2 0.8779
564 36Z 0.8779
565 QUS 0.8778
566 5UD 0.8776
567 LSQ 0.8776
568 7O4 0.8775
569 ST2 0.8775
570 BG6 0.8774
571 5WM 0.8772
572 6C5 0.8772
573 4EU 0.8772
574 JXK 0.8771
575 D3G 0.8771
576 NFK 0.8770
577 6Q3 0.8767
578 DBE 0.8766
579 6NZ 0.8765
580 SRO 0.8763
581 NOK 0.8763
582 26C 0.8763
583 NFZ 0.8761
584 WS7 0.8760
585 OKM 0.8759
586 BZQ 0.8759
587 4R1 0.8758
588 ENG 0.8758
589 GO2 0.8757
590 NIP 0.8757
591 YF3 0.8757
592 AWE 0.8756
593 5WU 0.8755
594 SLY 0.8753
595 AP6 0.8753
596 NHT 0.8753
597 GXD 0.8752
598 ONZ 0.8752
599 GC3 0.8752
600 F6P 0.8751
601 TMG 0.8750
602 VFG 0.8750
603 IQ5 0.8750
604 39Z 0.8749
605 CIY 0.8748
606 0OL 0.8748
607 OTA 0.8746
608 TOM 0.8745
609 6XC 0.8745
610 PTB 0.8745
611 KFN 0.8745
612 SKF 0.8744
613 NFM 0.8744
614 88R 0.8744
615 OPA 0.8744
616 TGW 0.8744
617 S7D 0.8743
618 CK1 0.8742
619 QZ8 0.8742
620 HC4 0.8741
621 92P 0.8741
622 ZEZ 0.8741
623 HIC 0.8740
624 9UG 0.8739
625 AXX 0.8739
626 3L1 0.8739
627 HNT 0.8738
628 68A 0.8738
629 1BW 0.8738
630 4BY 0.8737
631 N91 0.8736
632 JPQ 0.8735
633 OSB 0.8734
634 M6Z 0.8734
635 848 0.8733
636 RCV 0.8733
637 A5H 0.8732
638 LZB 0.8730
639 BQ5 0.8730
640 55D 0.8729
641 MQG 0.8729
642 PZP 0.8728
643 9VQ 0.8727
644 8RK 0.8725
645 IBM 0.8724
646 16Z 0.8722
647 TSS 0.8719
648 2O6 0.8719
649 FYR 0.8717
650 TCL 0.8715
651 6KT 0.8715
652 Y3L 0.8715
653 M2E 0.8715
654 3ZB 0.8714
655 AJG 0.8712
656 8Y7 0.8710
657 7PJ 0.8710
658 HX8 0.8710
659 TT4 0.8709
660 EE8 0.8709
661 5DE 0.8708
662 R9G 0.8708
663 OX2 0.8707
664 RKN 0.8705
665 428 0.8705
666 P80 0.8705
667 DE7 0.8705
668 3JC 0.8705
669 HPT 0.8704
670 E9P 0.8704
671 HBO 0.8703
672 GO8 0.8703
673 08C 0.8703
674 C09 0.8702
675 GJP 0.8702
676 3WK 0.8700
677 BA5 0.8700
678 IQZ 0.8699
679 PRL 0.8699
680 XG1 0.8698
681 FF2 0.8698
682 VGS 0.8697
683 CXH 0.8696
684 A4Q 0.8694
685 DX7 0.8692
686 MCY 0.8691
687 IPT 0.8690
688 C0H 0.8689
689 C82 0.8689
690 ARP 0.8688
691 5TY 0.8687
692 TZM 0.8686
693 6ZW 0.8685
694 TLF 0.8684
695 S0D 0.8684
696 S46 0.8684
697 5WS 0.8683
698 6FB 0.8682
699 LTM 0.8682
700 AJ4 0.8682
701 HQJ 0.8681
702 22T 0.8680
703 F6R 0.8680
704 VC3 0.8679
705 0NX 0.8679
706 MXD 0.8678
707 STT 0.8677
708 9X3 0.8677
709 67X 0.8676
710 X2M 0.8675
711 ZEC 0.8675
712 6J3 0.8675
713 GNW 0.8674
714 50C 0.8672
715 FIX 0.8672
716 092 0.8670
717 3LJ 0.8670
718 QH3 0.8670
719 TU0 0.8670
720 D80 0.8670
721 W23 0.8669
722 M3F 0.8668
723 KDG 0.8665
724 PNP 0.8665
725 VXX 0.8665
726 TYE 0.8664
727 XQI 0.8663
728 XZ8 0.8662
729 MIL 0.8662
730 K3Q 0.8661
731 3G3 0.8659
732 CKU 0.8659
733 COL 0.8659
734 K97 0.8658
735 3DT 0.8658
736 SG2 0.8657
737 C8O 0.8656
738 KW8 0.8655
739 6HO 0.8655
740 NPL 0.8655
741 7G1 0.8653
742 977 0.8653
743 92G 0.8653
744 9NB 0.8653
745 OA4 0.8652
746 UNJ 0.8651
747 4BX 0.8651
748 N2M 0.8650
749 ONR 0.8648
750 ZYQ 0.8648
751 2B4 0.8647
752 S7V 0.8647
753 A4V 0.8647
754 JHY 0.8647
755 2KU 0.8647
756 KMP 0.8645
757 KWH 0.8645
758 S7B 0.8645
759 0F9 0.8645
760 N3W 0.8644
761 OA1 0.8643
762 KWQ 0.8641
763 HHV 0.8640
764 R20 0.8640
765 J38 0.8631
766 O9Q 0.8631
767 C53 0.8631
768 P81 0.8629
769 S0I 0.8629
770 X0U 0.8627
771 5RP 0.8626
772 5SB 0.8625
773 NOC 0.8625
774 7R4 0.8624
775 G30 0.8622
776 4TU 0.8620
777 FC2 0.8620
778 327 0.8619
779 B0K 0.8619
780 O9Z 0.8617
781 LOT 0.8617
782 NAR 0.8616
783 BP6 0.8615
784 AGI 0.8615
785 HRM 0.8612
786 GF7 0.8609
787 D9Z 0.8609
788 ID8 0.8608
789 TB8 0.8606
790 2FX 0.8606
791 EZL 0.8603
792 K4V 0.8602
793 XDL XYP 0.8600
794 12T 0.8598
795 L22 0.8596
796 J84 0.8596
797 XIL 0.8595
798 NEO 0.8594
799 ABF 0.8594
800 N1Y 0.8593
801 2LX 0.8592
802 96U 0.8589
803 GNM 0.8587
804 GLP 0.8585
805 XYP XDN 0.8582
806 9FG 0.8582
807 XDN XYP 0.8582
808 A6P 0.8582
809 BZJ 0.8580
810 IM4 0.8579
811 STX 0.8579
812 SQ4 0.8577
813 EI1 0.8576
814 N2Y 0.8576
815 DX2 0.8574
816 SQ7 0.8571
817 HHR 0.8569
818 SNI 0.8567
819 6P3 0.8566
820 B2E 0.8562
821 STV 0.8561
822 UQ1 0.8561
823 B86 0.8558
824 J6W 0.8557
825 CUE 0.8554
826 IS2 0.8554
827 MFZ 0.8553
828 GI3 0.8552
829 3R6 0.8551
830 MAG 0.8549
831 36M 0.8545
832 1VK 0.8545
833 DK1 0.8540
834 AX3 0.8537
835 9ZE 0.8535
836 THA 0.8534
837 TIA 0.8530
838 YEX 0.8529
839 OLU 0.8526
840 HFA 0.8511
841 3XH 0.8511
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 6ZA4; Ligand: M83; 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: 6za4.bio3) has 20 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 6ZA4; Ligand: M83; Similar sites found with APoc: 2
This union binding pocket(no: 2) in the query (biounit: 6za4.bio1) has 40 residues
No: Leader PDB Ligand Sequence Similarity
1 1I7Q PYR 26.1062
2 1I7Q PYR 26.1062
Pocket No.: 3; Query (leader) PDB : 6ZA4; Ligand: M83; Similar sites found with APoc: 1
This union binding pocket(no: 3) in the query (biounit: 6za4.bio2) has 30 residues
No: Leader PDB Ligand Sequence Similarity
1 3R75 PYR 23.4513
Pocket No.: 4; Query (leader) PDB : 6ZA4; Ligand: M83; 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: 6za4.bio4) has 22 residues
No: Leader PDB Ligand Sequence Similarity
APoc FAQ
Feedback