Receptor
PDB id Resolution Class Description Source Keywords
5cge 1.62 Å EC: 2.7.1.50 STRUCTURE OF HYDROXYETHYLTHIAZOLE KINASE THIM FROM STAPHYLOC AUREUS IN COMPLEX WITH SUBSTRATE ANALOG 2-(2-METHYL-1H-IMIDY L)ETHANOL STAPHYLOCOCCUS AUREUS SUBSP. AUREUS MRORGANISM_TAXID: 282458 BACTERIAL THIAMINE BIOSYNTHESIS HYDROXYETHYLTHIAZOLE KINASESUBSTRATE ANALOG TRANSFERASE
Ref.: STRUCTURE OF THIM FROM VITAMIN B1 BIOSYNTHETIC PATH STAPHYLOCOCCUS AUREUS - INSIGHTS INTO A NOVEL PRO-D APPROACH ADDRESSING MRSA INFECTIONS. SCI REP V. 6 22871 2016
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
MG C:303;
B:302;
C:302;
A:302;
E:302;
 Part of Protein;
Invalid;
Part of Protein;
Invalid;
Part of Protein;
 none;
none;
none;
none;
none;
 submit data
24.305 Mg [Mg+2...
51F E:301;
D:301;
B:301;
A:301;
D:302;
C:301;
 Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
 none;
none;
none;
none;
none;
none;
 submit data
126.156 C6 H10 N2 O Cc1nc...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
5CGE 1.62 Å EC: 2.7.1.50 STRUCTURE OF HYDROXYETHYLTHIAZOLE KINASE THIM FROM STAPHYLOC AUREUS IN COMPLEX WITH SUBSTRATE ANALOG 2-(2-METHYL-1H-IMIDY L)ETHANOL STAPHYLOCOCCUS AUREUS SUBSP. AUREUS MRORGANISM_TAXID: 282458 BACTERIAL THIAMINE BIOSYNTHESIS HYDROXYETHYLTHIAZOLE KINASESUBSTRATE ANALOG TRANSFERASE
Ref.: STRUCTURE OF THIM FROM VITAMIN B1 BIOSYNTHETIC PATH STAPHYLOCOCCUS AUREUS - INSIGHTS INTO A NOVEL PRO-D APPROACH ADDRESSING MRSA INFECTIONS. SCI REP V. 6 22871 2016
Members (3)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 5CGA - KP6 C8 H14 N2 O Cc1c(c(n(n....
2 5COJ - TZE C6 H9 N O S Cc1c(scn1)....
3 5CGE - 51F C6 H10 N2 O Cc1nccn1CC....
70% Homology Family (3)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 5CGA - KP6 C8 H14 N2 O Cc1c(c(n(n....
2 5COJ - TZE C6 H9 N O S Cc1c(scn1)....
3 5CGE - 51F C6 H10 N2 O Cc1nccn1CC....
50% Homology Family (6)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 5CGA - KP6 C8 H14 N2 O Cc1c(c(n(n....
2 5COJ - TZE C6 H9 N O S Cc1c(scn1)....
3 5CGE - 51F C6 H10 N2 O Cc1nccn1CC....
4 1ESQ - TZP C6 H10 N O4 P S Cc1c(scn1)....
5 1EKK - TZE C6 H9 N O S Cc1c(scn1)....
6 1C3Q - TZE C6 H9 N O S Cc1c(scn1)....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: 51F; Similar ligands found: 1
No: Ligand ECFP6 Tc MDL keys Tc
1 51F 1 1
Similar Ligands (3D)
Ligand no: 1; Ligand: 51F; Similar ligands found: 890
No: Ligand Similarity coefficient
1 TZE 0.9914
2 1LN 0.9764
3 5AC 0.9764
4 JZ4 0.9744
5 PRY 0.9742
6 261 0.9731
7 BSX 0.9726
8 278 0.9669
9 PZI 0.9665
10 HY3 0.9651
11 PEL 0.9645
12 271 0.9638
13 HSM 0.9633
14 PEA 0.9626
15 1DU 0.9620
16 280 0.9608
17 FP1 0.9606
18 1AB 0.9606
19 OXQ 0.9596
20 EDG 0.9594
21 CEE 0.9594
22 GAG 0.9580
23 R8A 0.9572
24 SYN 0.9562
25 JZ5 0.9554
26 HY1 0.9551
27 APY 0.9547
28 2LP 0.9542
29 R2B 0.9536
30 R1X 0.9536
31 JZ3 0.9515
32 ABN 0.9500
33 IMR 0.9498
34 GBD 0.9497
35 6PC 0.9492
36 69O 0.9491
37 PRO 0.9473
38 TFB 0.9472
39 PYJ 0.9470
40 PY7 0.9469
41 JZ1 0.9468
42 9X7 0.9467
43 PCA 0.9463
44 MZ0 0.9457
45 AMC 0.9451
46 AHR 0.9449
47 NBE 0.9445
48 CXF 0.9443
49 HBX 0.9442
50 286 0.9427
51 60P 0.9427
52 NEQ 0.9426
53 NK 0.9412
54 KP6 0.9408
55 THE 0.9406
56 CRN 0.9406
57 9CL 0.9405
58 R9S 0.9401
59 OAA 0.9400
60 CMS 0.9395
61 B24 0.9394
62 2DR 0.9390
63 UGC 0.9383
64 47J 0.9383
65 SR1 0.9382
66 RIB 0.9381
67 1MR 0.9381
68 FUB 0.9373
69 JZ7 0.9372
70 HCS 0.9371
71 MRZ 0.9371
72 ES6 0.9369
73 COI 0.9365
74 BAM 0.9361
75 FPI 0.9359
76 BEN 0.9352
77 M58 0.9352
78 IOM 0.9351
79 282 0.9351
80 NIO 0.9350
81 HSE 0.9349
82 0R0 0.9349
83 IP0 0.9347
84 VAH 0.9339
85 ITN 0.9338
86 1WD 0.9337
87 QY9 0.9337
88 T2C 0.9336
89 7WG 0.9334
90 4SV 0.9333
91 SS2 0.9329
92 TZL 0.9326
93 ZBT 0.9326
94 ASP 0.9325
95 SAL 0.9325
96 2EZ 0.9324
97 IZC 0.9324
98 VNJ 0.9322
99 LMR 0.9319
100 3SK 0.9317
101 PRI 0.9316
102 PRZ 0.9314
103 KYD 0.9313
104 JKE 0.9312
105 PYC 0.9309
106 DAB 0.9309
107 BVG 0.9308
108 NVI 0.9306
109 NVA 0.9303
110 RSO 0.9301
111 2AL 0.9301
112 YCP 0.9297
113 PZA 0.9294
114 NCA 0.9294
115 3U4 0.9291
116 LER 0.9289
117 2CO 0.9286
118 HVQ 0.9284
119 BE2 0.9283
120 OHP 0.9281
121 ASN 0.9281
122 IQ0 0.9278
123 TZC 0.9278
124 BEZ 0.9276
125 4CS 0.9273
126 SS1 0.9272
127 FEH 0.9272
128 XBT 0.9271
129 MLT 0.9271
130 9YL 0.9269
131 ORN 0.9267
132 268 0.9266
133 PAC 0.9264
134 HBA 0.9262
135 EHM 0.9262
136 7N0 0.9260
137 UYA 0.9258
138 IT2 0.9253
139 I4B 0.9253
140 T9G 0.9253
141 1PT 0.9252
142 32O 0.9252
143 OHG 0.9252
144 7WV 0.9251
145 NLE 0.9251
146 40E 0.9251
147 L3Q 0.9250
148 AKG 0.9249
149 MXN 0.9249
150 QSC 0.9247
151 DAS 0.9246
152 KIV 0.9246
153 DUC 0.9238
154 ILE 0.9238
155 RUU 0.9234
156 URS 0.9231
157 2PC 0.9230
158 258 0.9229
159 HPY 0.9228
160 FPK 0.9228
161 UNU 0.9226
162 2KT 0.9224
163 NYL 0.9223
164 LDU 0.9223
165 NBZ 0.9222
166 AC0 0.9220
167 URA 0.9220
168 KOJ 0.9219
169 OXZ 0.9219
170 2XX 0.9217
171 IFM 0.9215
172 UY7 0.9214
173 BVC 0.9212
174 FAN 0.9210
175 DOR 0.9209
176 JBN 0.9208
177 XLS 0.9207
178 IDM 0.9207
179 HYP 0.9204
180 TEO 0.9204
181 C2A 0.9204
182 ALO 0.9202
183 ISZ 0.9202
184 CSS 0.9202
185 SMV 0.9202
186 CIZ 0.9201
187 MRY 0.9200
188 PBC 0.9198
189 3XX 0.9190
190 YRL 0.9188
191 NXA 0.9187
192 BNS 0.9187
193 DFB 0.9187
194 XUL 0.9185
195 JZ9 0.9185
196 BHO 0.9183
197 LT1 0.9182
198 O7U 0.9181
199 AKB 0.9179
200 RSF 0.9179
201 MAK 0.9179
202 PYF 0.9177
203 HZP 0.9175
204 1DJ 0.9173
205 1P3 0.9171
206 ABU 0.9166
207 1DQ 0.9166
208 FBV 0.9164
209 HPA 0.9163
210 SPA 0.9163
211 SRT 0.9159
212 AEF 0.9159
213 BP9 0.9159
214 4JL 0.9158
215 RHU 0.9158
216 IHG 0.9158
217 VAL 0.9157
218 LYL 0.9156
219 AC5 0.9155
220 2RH 0.9152
221 49F 0.9152
222 JYD 0.9150
223 MET 0.9149
224 5HY 0.9147
225 3PY 0.9147
226 9TY 0.9146
227 CAQ 0.9144
228 VGL 0.9141
229 273 0.9141
230 N4B 0.9139
231 HYA 0.9138
232 IPZ 0.9137
233 FB1 0.9137
234 BDR 0.9133
235 THR 0.9133
236 ZZ3 0.9130
237 4FA 0.9130
238 TAR 0.9130
239 FOA 0.9129
240 AZF 0.9128
241 MZW 0.9127
242 26D 0.9127
243 4VP 0.9125
244 PEP 0.9125
245 JAB 0.9123
246 MNN 0.9122
247 MLE 0.9121
248 KMT 0.9120
249 DPR 0.9119
250 3AL 0.9118
251 Z6J 0.9117
252 SC2 0.9115
253 NTN 0.9111
254 S2G 0.9110
255 XM0 0.9110
256 CYS 0.9110
257 SYG 0.9109
258 BNF 0.9108
259 CFI 0.9104
260 GLL 0.9104
261 HGQ 0.9102
262 BZX 0.9101
263 S76 0.9101
264 SMB 0.9101
265 PRS 0.9101
266 FYU 0.9100
267 PBE 0.9099
268 34V 0.9098
269 ASC 0.9098
270 FW5 0.9096
271 GYE 0.9095
272 M4T 0.9094
273 M6W 0.9091
274 H3M 0.9091
275 TLA 0.9090
276 23W 0.9090
277 MEV 0.9088
278 KSW 0.9086
279 39J 0.9086
280 3OC 0.9084
281 FBA 0.9083
282 QFH 0.9082
283 GLN 0.9082
284 F81 0.9081
285 MED 0.9080
286 2TQ 0.9079
287 URF 0.9077
288 MUC 0.9075
289 MLI 0.9075
290 SHA 0.9074
291 GIF 0.9074
292 BML 0.9074
293 ORO 0.9072
294 EV0 0.9070
295 ROR 0.9069
296 2A7 0.9069
297 LEU 0.9068
298 7HP 0.9065
299 IPH 0.9065
300 XYP 0.9064
301 MMZ 0.9064
302 RBJ 0.9064
303 53C 0.9062
304 HDA 0.9061
305 RBL 0.9061
306 CRS 0.9060
307 ADE 0.9060
308 DTL 0.9060
309 I1E 0.9055
310 AGK 0.9053
311 ICF 0.9051
312 1SP 0.9049
313 AS3 0.9049
314 C2B 0.9049
315 I2M 0.9047
316 DCL 0.9047
317 4XR 0.9046
318 BEW 0.9046
319 PHU 0.9045
320 3NT 0.9044
321 ONL 0.9044
322 HUI 0.9044
323 DCY 0.9044
324 2AS 0.9042
325 8EZ 0.9042
326 192 0.9039
327 H76 0.9039
328 FBJ 0.9038
329 ISD 0.9038
330 NSP 0.9037
331 A3B 0.9036
332 IFL 0.9033
333 ICC 0.9033
334 G4D 0.9031
335 JFJ 0.9031
336 SER 0.9031
337 PMB 0.9029
338 HIO 0.9028
339 6F0 0.9028
340 RIP 0.9027
341 SNE 0.9023
342 MLM 0.9022
343 WBU 0.9020
344 SGL 0.9020
345 DGN 0.9019
346 24B 0.9018
347 HSO 0.9017
348 NOJ 0.9015
349 IDH 0.9013
350 12M 0.9013
351 285 0.9012
352 LDP 0.9012
353 PRA 0.9011
354 NMJ 0.9010
355 2IT 0.9010
356 DGL 0.9010
357 LRH 0.9009
358 AHB 0.9006
359 SPV 0.9005
360 MLA 0.9004
361 OGA 0.9003
362 2HG 0.9003
363 ECE 0.9003
364 VKC 0.9001
365 OK7 0.9001
366 C21 0.8996
367 KG7 0.8996
368 LEA 0.8995
369 ARW 0.8995
370 GGL 0.8994
371 GLU 0.8994
372 DMJ 0.8994
373 XYS 0.8993
374 6UA 0.8991
375 5RG 0.8988
376 GAB 0.8987
377 RB5 0.8987
378 XYL 0.8987
379 ABA 0.8986
380 NIZ 0.8984
381 RM1 0.8981
382 9DA 0.8981
383 Q88 0.8977
384 HHA 0.8976
385 CYT 0.8975
386 URP 0.8974
387 4CH 0.8973
388 54D 0.8972
389 DEE 0.8972
390 1DV 0.8971
391 HIU 0.8971
392 RCO 0.8970
393 R67 0.8970
394 284 0.8969
395 JBE 0.8968
396 HIS 0.8967
397 KPL 0.8967
398 10L 0.8967
399 BE7 0.8965
400 MB3 0.8965
401 6CS 0.8964
402 FUM 0.8962
403 F9P 0.8960
404 TPA 0.8959
405 03W 0.8959
406 DGY 0.8959
407 TP5 0.8959
408 DMV 0.8958
409 98J 0.8957
410 40O 0.8957
411 717 0.8955
412 HMH 0.8953
413 DHS 0.8945
414 4JU 0.8945
415 2MH 0.8945
416 ARB 0.8944
417 OEM 0.8944
418 FBM 0.8944
419 PAF 0.8944
420 PG3 0.8943
421 MD0 0.8943
422 9HX 0.8943
423 PEZ 0.8942
424 2EH 0.8941
425 SKG 0.8941
426 LCN 0.8940
427 LG3 0.8940
428 2CL 0.8940
429 ZZT 0.8939
430 FB2 0.8939
431 M2H 0.8939
432 93B 0.8937
433 2CK 0.8937
434 FLA 0.8936
435 2PG 0.8936
436 GJZ 0.8935
437 GUN 0.8935
438 TMH 0.8934
439 C2N 0.8934
440 MAN 0.8934
441 NMG 0.8933
442 4MV 0.8933
443 HMU 0.8933
444 PAB 0.8932
445 PMF 0.8932
446 IT9 0.8932
447 GTQ 0.8931
448 GLC 0.8928
449 RP7 0.8928
450 7WA 0.8928
451 F05 0.8928
452 GRO 0.8926
453 14J 0.8925
454 260 0.8925
455 PO6 0.8925
456 SSN 0.8924
457 DCD 0.8922
458 NFM 0.8921
459 3HB 0.8920
460 6MP 0.8920
461 MSE 0.8918
462 B2J 0.8917
463 9DG 0.8917
464 LG5 0.8916
465 URO 0.8916
466 SIN 0.8916
467 5CU 0.8915
468 DSN 0.8915
469 BVF 0.8914
470 CEJ 0.8914
471 5NU 0.8912
472 8GF 0.8910
473 SWD 0.8908
474 6M1 0.8908
475 GRE 0.8907
476 ES4 0.8907
477 MNM 0.8904
478 BP1 0.8904
479 D1X 0.8904
480 PYG 0.8902
481 3HP 0.8902
482 NPO 0.8901
483 T6C 0.8901
484 ARA 0.8900
485 64K 0.8900
486 F06 0.8898
487 1XX 0.8898
488 3AB 0.8897
489 OVV 0.8897
490 PPR 0.8895
491 7A8 0.8894
492 PM6 0.8894
493 RMN 0.8893
494 AX2 0.8893
495 3CH 0.8890
496 BTE 0.8890
497 OMD 0.8890
498 PHB 0.8890
499 DOB 0.8889
500 6LW 0.8889
501 0MK 0.8889
502 4NG 0.8889
503 DIG 0.8888
504 265 0.8887
505 DEN 0.8887
506 G2F 0.8886
507 XAN 0.8885
508 GVH 0.8885
509 BGC 0.8884
510 AUD 0.8882
511 1GP 0.8880
512 SMN 0.8876
513 263 0.8876
514 CXL 0.8875
515 DXX 0.8874
516 MAE 0.8874
517 23B 0.8873
518 5MK 0.8872
519 3ZQ 0.8872
520 H8N 0.8872
521 3SL 0.8871
522 HX3 0.8870
523 LYS 0.8868
524 4JP 0.8868
525 URQ 0.8867
526 HSL 0.8867
527 TH7 0.8864
528 CIG 0.8863
529 SEJ 0.8862
530 A1U 0.8862
531 LZ1 0.8862
532 7MH 0.8861
533 MSN 0.8860
534 2IM 0.8860
535 54G 0.8859
536 4NC 0.8859
537 4H2 0.8859
538 4RW 0.8859
539 SJ5 0.8858
540 0R1 0.8857
541 HYN 0.8856
542 9RW 0.8855
543 YHO 0.8854
544 WCE 0.8854
545 8OZ 0.8854
546 DTU 0.8853
547 BDF 0.8852
548 DMI 0.8852
549 7C3 0.8852
550 3Z7 0.8851
551 AEG 0.8850
552 WDL 0.8849
553 HEW 0.8847
554 IND 0.8847
555 ASO 0.8846
556 SYC 0.8846
557 OXC 0.8845
558 CDV 0.8844
559 L60 0.8844
560 23A 0.8843
561 FRU 0.8843
562 IF7 0.8843
563 3HA 0.8843
564 4HP 0.8841
565 K7M 0.8840
566 42J 0.8839
567 Z82 0.8839
568 3AY 0.8838
569 RNS 0.8838
570 13X 0.8837
571 BUA 0.8837
572 3HL 0.8836
573 B85 0.8835
574 MCT 0.8834
575 PBZ 0.8834
576 SX1 0.8833
577 4ZE 0.8833
578 5AN 0.8832
579 XCZ 0.8830
580 FUF 0.8829
581 FPY 0.8829
582 HHN 0.8829
583 BZF 0.8827
584 AW5 0.8827
585 6M4 0.8825
586 AC6 0.8824
587 34D 0.8824
588 3M0 0.8824
589 6JN 0.8823
590 DHB 0.8822
591 FA1 0.8822
592 J1Z 0.8822
593 2ZX 0.8822
594 AAE 0.8822
595 M3T 0.8821
596 HRZ 0.8820
597 HPS 0.8819
598 4XV 0.8817
599 HVK 0.8816
600 DBB 0.8815
601 4HO 0.8815
602 8GC 0.8814
603 DBH 0.8814
604 G2H 0.8812
605 FK8 0.8812
606 MWM 0.8812
607 HX2 0.8812
608 3V4 0.8808
609 4XX 0.8808
610 HAI 0.8808
611 BZI 0.8808
612 DTT 0.8807
613 A2Q 0.8806
614 3F0 0.8806
615 9TZ 0.8805
616 5ZE 0.8805
617 CYH 0.8805
618 BR8 0.8803
619 JIF 0.8803
620 MPI 0.8802
621 B3R 0.8802
622 5M0 0.8801
623 DHK 0.8801
624 IVA 0.8799
625 93Q 0.8799
626 5HN 0.8798
627 DS0 0.8794
628 2AP 0.8792
629 GXE 0.8791
630 3BZ 0.8791
631 SVD 0.8790
632 XQG 0.8790
633 2AC 0.8789
634 DFU 0.8788
635 7EX 0.8788
636 LGA 0.8787
637 23J 0.8787
638 0CT 0.8787
639 MBN 0.8786
640 TDR 0.8786
641 4AX 0.8785
642 PIH 0.8785
643 XYD 0.8784
644 HDH 0.8783
645 SHI 0.8782
646 1LQ 0.8781
647 HH5 0.8781
648 HCI 0.8780
649 IPB 0.8780
650 FQI 0.8777
651 8CL 0.8776
652 3AP 0.8775
653 TM7 0.8775
654 2RA 0.8774
655 HBD 0.8774
656 DGJ 0.8774
657 264 0.8773
658 1MC 0.8772
659 CP 0.8770
660 KTA 0.8770
661 HGW 0.8769
662 92Z 0.8768
663 L89 0.8767
664 V1L 0.8767
665 N7P 0.8766
666 FBT 0.8766
667 EUG 0.8766
668 HQ9 0.8765
669 H95 0.8765
670 NOY 0.8764
671 1Y6 0.8764
672 GZL 0.8764
673 PLQ 0.8763
674 9PO 0.8763
675 K5W 0.8762
676 2YU 0.8762
677 449 0.8762
678 HQE 0.8762
679 069 0.8760
680 7MU 0.8757
681 GAL 0.8756
682 WOT 0.8755
683 PAV 0.8754
684 2AF 0.8753
685 OXE 0.8753
686 BRT 0.8753
687 4M0 0.8751
688 XBZ 0.8750
689 BHA 0.8750
690 4PW 0.8749
691 4AP 0.8749
692 P2D 0.8748
693 51R 0.8747
694 FA0 0.8745
695 FUL 0.8744
696 173 0.8744
697 3HR 0.8744
698 MEQ 0.8744
699 R9M 0.8742
700 B40 0.8741
701 4MA 0.8741
702 N8P 0.8738
703 MFU 0.8738
704 ICP 0.8738
705 DMG 0.8738
706 GOO 0.8738
707 24T 0.8737
708 RAM 0.8737
709 XSP 0.8735
710 269 0.8734
711 YAN 0.8734
712 3DO 0.8734
713 8EW 0.8733
714 938 0.8730
715 4HS 0.8730
716 2D0 0.8729
717 4SD 0.8729
718 NCM 0.8729
719 GG6 0.8729
720 TTO 0.8727
721 HHQ 0.8727
722 PGA 0.8726
723 ES0 0.8724
724 DA1 0.8723
725 P3K 0.8722
726 AFR 0.8720
727 AZA 0.8719
728 1AC 0.8718
729 FSG 0.8717
730 OTR 0.8716
731 7B4 0.8716
732 9TW 0.8714
733 EGD 0.8711
734 GIV 0.8711
735 A09 0.8710
736 BU4 0.8710
737 6X8 0.8707
738 GUA 0.8706
739 P9P 0.8705
740 4CL 0.8705
741 TMZ 0.8705
742 2CH 0.8704
743 SAR 0.8704
744 1CB 0.8704
745 0V5 0.8702
746 GLA 0.8702
747 4JJ 0.8702
748 SAT 0.8702
749 1AN 0.8702
750 LG4 0.8701
751 ABE 0.8701
752 PKU 0.8698
753 CWM 0.8698
754 FBW 0.8698
755 BR9 0.8697
756 HTS 0.8696
757 FPN 0.8696
758 PEQ 0.8696
759 BUQ 0.8695
760 3DM 0.8694
761 XX2 0.8694
762 JZ0 0.8694
763 6HQ 0.8694
764 QMP 0.8693
765 9EW 0.8693
766 PAE 0.8692
767 13P 0.8691
768 27Y 0.8691
769 FP2 0.8690
770 A2F 0.8689
771 ICN 0.8687
772 3FH 0.8686
773 FUC 0.8686
774 P72 0.8685
775 TSS 0.8685
776 4XS 0.8685
777 6AP 0.8685
778 PCR 0.8683
779 5JC 0.8682
780 SEP 0.8682
781 76X 0.8680
782 DTI 0.8680
783 PSV 0.8680
784 BUB 0.8680
785 4HM 0.8679
786 MTG 0.8678
787 GAF 0.8677
788 9X6 0.8677
789 BMA 0.8675
790 DIE 0.8670
791 8LG 0.8670
792 HHT 0.8670
793 LGC 0.8670
794 C5J 0.8669
795 25R 0.8668
796 SOE 0.8667
797 149 0.8666
798 6AI 0.8665
799 HC4 0.8664
800 MZG 0.8664
801 FA3 0.8662
802 OPE 0.8660
803 SVN 0.8659
804 3MC 0.8659
805 BAL 0.8658
806 2K4 0.8658
807 JZ2 0.8656
808 PXY 0.8655
809 NTM 0.8651
810 CHT 0.8650
811 F60 0.8648
812 SW7 0.8648
813 MFB 0.8645
814 BPW 0.8644
815 5H1 0.8640
816 G3F 0.8639
817 2FG 0.8637
818 BMD 0.8634
819 KBB 0.8633
820 GLY GLY 0.8632
821 42C 0.8632
822 IPM 0.8632
823 MWJ 0.8632
824 2ZV 0.8629
825 A13 0.8629
826 1GN 0.8628
827 MZY 0.8626
828 3FA 0.8625
829 14O 0.8624
830 IJZ 0.8624
831 2C9 0.8623
832 TH0 0.8623
833 AH8 0.8621
834 FOT 0.8620
835 PAH 0.8620
836 HXX 0.8618
837 Q6T 0.8612
838 YIO 0.8612
839 ZGL 0.8610
840 LNO 0.8607
841 ICB 0.8606
842 0TR 0.8605
843 MBD 0.8604
844 4ZC 0.8602
845 5MB 0.8602
846 K6H 0.8600
847 2H5 0.8600
848 ES9 0.8599
849 FCR 0.8598
850 5MI 0.8598
851 XXR 0.8596
852 2FY 0.8595
853 8S0 0.8595
854 0LH 0.8595
855 XAP 0.8595
856 SF9 0.8593
857 1XM 0.8593
858 HL4 0.8592
859 AX7 0.8591
860 270 0.8591
861 4JN 0.8591
862 ODV 0.8588
863 GXL 0.8587
864 EYK 0.8587
865 0CU 0.8580
866 BXO 0.8576
867 45L 0.8575
868 ABV 0.8575
869 7VD 0.8572
870 GLF 0.8572
871 S24 0.8571
872 B53 0.8570
873 FCB 0.8567
874 P92 0.8567
875 9KH 0.8566
876 BDP 0.8564
877 Y8I 0.8563
878 4JT 0.8562
879 KBG 0.8559
880 QM1 0.8557
881 FJO 0.8557
882 LNR 0.8557
883 MYQ 0.8555
884 BAQ 0.8554
885 RM4 0.8550
886 82I 0.8548
887 G8M 0.8546
888 KLW 0.8544
889 X6X 0.8542
890 BAE 0.8503
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 5CGE; Ligand: 51F; 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: 5cge.bio1) has 15 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 5CGE; Ligand: 51F; 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: 5cge.bio1) has 15 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 3; Query (leader) PDB : 5CGE; Ligand: 51F; 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: 5cge.bio1) has 14 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 4; Query (leader) PDB : 5CGE; Ligand: 51F; 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: 5cge.bio2) has 18 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 5; Query (leader) PDB : 5CGE; Ligand: 51F; 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: 5cge.bio2) has 29 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 6; Query (leader) PDB : 5CGE; Ligand: 51F; 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: 5cge.bio2) has 23 residues
No: Leader PDB Ligand Sequence Similarity
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