Receptor
PDB id Resolution Class Description Source Keywords
6I0P 1.9 Å EC: 2.5.1.72 STRUCTURE OF QUINOLINATE SYNTHASE IN COMPLEX WITH 6-MERCAPTO 2,3-DICARBOXYLIC ACID THERMOTOGA MARITIMA (STRAIN ATCC 43589DSM 3109 / JCM 10099) NAD BIOSYNTHESIS IRON SULFUR CLUSTER TRANSFERASE
Ref.: DESIGN OF SPECIFIC INHIBITORS OF QUINOLINATE SYNTHA ON [4FE-4S] CLUSTER COORDINATION. CHEM.COMMUN.(CAMB.) V. 55 3725 2019
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
SF4 A:301;
 Part of Protein;
 none;
 submit data
351.64 Fe4 S4 [S]12...
QAS A:302;
 Valid;
 none;
 submit data
199.184 C7 H5 N O4 S c1cc(...
PO4 A:304;
 Invalid;
 none;
 submit data
94.971 O4 P [O-]P...
CL A:303;
 Invalid;
 none;
 submit data
35.453 Cl [Cl-]
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
5F33 1.45 Å EC: 2.5.1.72 STRUCTURE OF QUINOLINATE SYNTHASE IN COMPLEX WITH PHOSPHOGLYCOLOHYDROXAMATE THERMOTOGA MARITIMA MSB8 NAD BIOSYNTHESIS IRON SULFUR CLUSTER TRANSFERASE
Ref.: CRYSTAL STRUCTURES OF QUINOLINATE SYNTHASE IN COMPL SUBSTRATE ANALOGUE, THE CONDENSATION INTERMEDIATE, SUBSTRATE-DERIVED PRODUCT. J.AM.CHEM.SOC. V. 138 11802 2016
Members (11)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 5F3D - 5UK C7 H9 N O6 [H]/N=C([C....
2 6I0P - QAS C7 H5 N O4 S c1cc(nc(c1....
3 5F33 - PGH C2 H6 N O6 P C(C(=O)NO)....
4 6F48 - XQB C7 H9 N O6 [H]/N=C(/[....
5 5LQS - NTM C7 H5 N O4 c1cc(c(nc1....
6 6F4L - NTM C7 H5 N O4 c1cc(c(nc1....
7 5F35 - FLC C6 H5 O7 C(C(=O)[O-....
8 6G74 - PHT C8 H6 O4 c1ccc(c(c1....
9 6I0K - GZ8 C8 H6 O4 S C1=CC(=S)C....
10 5LQM - FLC C6 H5 O7 C(C(=O)[O-....
11 6I0R - QAT C7 H5 N O4 S C1C(=S)C=N....
70% Homology Family (23)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 5KTS - CIZ C5 H6 O4 C/C(=C/C(=....
2 6OR8 - 5XR C7 H11 N O7 C(C=O)[C@@....
3 5KTR - MAE C4 H4 O4 C(=C/C(=O)....
4 6NSU - DYA C4 H5 N O4 C(=C(/C(=O....
5 6NSO - 13P C3 H7 O6 P C(C(=O)COP....
6 5KTP - ITN C5 H6 O4 C=C(CC(=O)....
7 1WZU - MLT C4 H6 O5 C([C@H](C(....
8 5KTO - NTM C7 H5 N O4 c1cc(c(nc1....
9 6ORA - 5XR C7 H11 N O7 C(C=O)[C@@....
10 5KTN - 13P C3 H7 O6 P C(C(=O)COP....
11 4ZK6 - NTM C7 H5 N O4 c1cc(c(nc1....
12 5KTT - LMR C4 H6 O5 C([C@@H](C....
13 5F3D - 5UK C7 H9 N O6 [H]/N=C([C....
14 6I0P - QAS C7 H5 N O4 S c1cc(nc(c1....
15 5F33 - PGH C2 H6 N O6 P C(C(=O)NO)....
16 6F48 - XQB C7 H9 N O6 [H]/N=C(/[....
17 5LQS - NTM C7 H5 N O4 c1cc(c(nc1....
18 6F4L - NTM C7 H5 N O4 c1cc(c(nc1....
19 5F35 - FLC C6 H5 O7 C(C(=O)[O-....
20 6G74 - PHT C8 H6 O4 c1ccc(c(c1....
21 6I0K - GZ8 C8 H6 O4 S C1=CC(=S)C....
22 5LQM - FLC C6 H5 O7 C(C(=O)[O-....
23 6I0R - QAT C7 H5 N O4 S C1C(=S)C=N....
50% Homology Family (23)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 5KTS - CIZ C5 H6 O4 C/C(=C/C(=....
2 6OR8 - 5XR C7 H11 N O7 C(C=O)[C@@....
3 5KTR - MAE C4 H4 O4 C(=C/C(=O)....
4 6NSU - DYA C4 H5 N O4 C(=C(/C(=O....
5 6NSO - 13P C3 H7 O6 P C(C(=O)COP....
6 5KTP - ITN C5 H6 O4 C=C(CC(=O)....
7 1WZU - MLT C4 H6 O5 C([C@H](C(....
8 5KTO - NTM C7 H5 N O4 c1cc(c(nc1....
9 6ORA - 5XR C7 H11 N O7 C(C=O)[C@@....
10 5KTN - 13P C3 H7 O6 P C(C(=O)COP....
11 4ZK6 - NTM C7 H5 N O4 c1cc(c(nc1....
12 5KTT - LMR C4 H6 O5 C([C@@H](C....
13 5F3D - 5UK C7 H9 N O6 [H]/N=C([C....
14 6I0P - QAS C7 H5 N O4 S c1cc(nc(c1....
15 5F33 - PGH C2 H6 N O6 P C(C(=O)NO)....
16 6F48 - XQB C7 H9 N O6 [H]/N=C(/[....
17 5LQS - NTM C7 H5 N O4 c1cc(c(nc1....
18 6F4L - NTM C7 H5 N O4 c1cc(c(nc1....
19 5F35 - FLC C6 H5 O7 C(C(=O)[O-....
20 6G74 - PHT C8 H6 O4 c1ccc(c(c1....
21 6I0K - GZ8 C8 H6 O4 S C1=CC(=S)C....
22 5LQM - FLC C6 H5 O7 C(C(=O)[O-....
23 6I0R - QAT C7 H5 N O4 S C1C(=S)C=N....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: QAS; Similar ligands found: 1
No: Ligand ECFP6 Tc MDL keys Tc
1 QAS 1 1
Similar Ligands (3D)
Ligand no: 1; Ligand: QAS; Similar ligands found: 712
No: Ligand Similarity coefficient
1 GZ8 0.9984
2 YQA 0.9936
3 GM7 0.9910
4 QAT 0.9882
5 GJS 0.9799
6 PHT 0.9703
7 NTM 0.9689
8 KLW 0.9672
9 SXS 0.9625
10 EJZ 0.9623
11 LSA 0.9620
12 ZZ8 0.9501
13 MWP 0.9458
14 3MG 0.9439
15 UEG 0.9429
16 APZ 0.9422
17 20J 0.9411
18 GCS 0.9396
19 QX4 0.9386
20 KT7 0.9384
21 8S0 0.9376
22 Q71 0.9352
23 BGC 0.9349
24 URC 0.9349
25 G3F 0.9332
26 PXL 0.9330
27 8TX 0.9310
28 0P6 0.9308
29 NCD 0.9306
30 AIN 0.9279
31 2MN 0.9278
32 DQU 0.9276
33 CWS 0.9274
34 4HC 0.9266
35 UFO 0.9262
36 GLC 0.9261
37 GAL 0.9261
38 D07 0.9260
39 INE 0.9259
40 QBK 0.9255
41 4M0 0.9254
42 GOG 0.9253
43 PX7 0.9240
44 9MG 0.9238
45 9DG 0.9238
46 3Z8 0.9235
47 FA0 0.9223
48 HJP 0.9222
49 KUF 0.9220
50 5CU 0.9219
51 DBX 0.9218
52 DPZ 0.9218
53 2ZQ 0.9216
54 B55 0.9215
55 4TE 0.9212
56 A7W 0.9202
57 6CS 0.9202
58 8CM 0.9201
59 BTY 0.9200
60 MRW 0.9198
61 5NU 0.9198
62 VOH 0.9195
63 B5D 0.9193
64 B62 0.9193
65 FBG 0.9192
66 UNC 0.9186
67 8IG 0.9183
68 680 0.9180
69 PXM 0.9179
70 G5V 0.9177
71 BHA 0.9175
72 HLZ 0.9173
73 7B4 0.9173
74 54G 0.9173
75 DIN 0.9172
76 XAZ 0.9169
77 3TJ 0.9168
78 4ME 0.9161
79 XHP 0.9160
80 3IT 0.9157
81 HXX 0.9155
82 7A2 0.9152
83 2D0 0.9152
84 XAN 0.9152
85 DOB 0.9150
86 5RG 0.9148
87 0FO 0.9148
88 FOT 0.9147
89 1U1 0.9146
90 SRO 0.9144
91 AZA 0.9144
92 NID 0.9143
93 DBJ 0.9142
94 PE0 0.9140
95 OTW 0.9140
96 Q7A 0.9140
97 AKH 0.9138
98 Q24 0.9136
99 2EC 0.9134
100 NDM 0.9134
101 LGC 0.9133
102 AJ2 0.9133
103 MUA 0.9130
104 GTQ 0.9129
105 GTZ 0.9124
106 GUN 0.9124
107 495 0.9123
108 7ZE 0.9122
109 AZ8 0.9121
110 GHM 0.9120
111 1XN 0.9118
112 BMA 0.9117
113 75K 0.9115
114 7VJ 0.9114
115 7VS 0.9114
116 TRC 0.9114
117 FYU 0.9111
118 FLC 0.9110
119 GCU 0.9109
120 MVN 0.9108
121 KIB 0.9108
122 IPB 0.9105
123 Q77 0.9104
124 M3S 0.9102
125 MT0 0.9101
126 7NI 0.9099
127 GT0 0.9098
128 4Z4 0.9098
129 IJZ 0.9097
130 9TZ 0.9096
131 ENL 0.9096
132 F12 0.9095
133 E7Z 0.9095
134 42C 0.9094
135 Q6T 0.9094
136 I6G 0.9093
137 4MU 0.9093
138 SX1 0.9093
139 0W8 0.9092
140 M5K 0.9092
141 141 0.9092
142 ADZ 0.9091
143 M0W 0.9088
144 5M0 0.9088
145 1XM 0.9086
146 1LQ 0.9086
147 IGA 0.9086
148 N5J 0.9085
149 MBG 0.9085
150 SHG 0.9085
151 329 0.9083
152 GOX 0.9081
153 ES0 0.9080
154 BDP 0.9080
155 AQO 0.9077
156 12B 0.9075
157 JPZ 0.9073
158 JBH 0.9073
159 4YS 0.9071
160 AZG 0.9070
161 CFP 0.9070
162 I3A 0.9064
163 6M4 0.9064
164 ZB1 0.9062
165 PYQ 0.9061
166 NTZ 0.9060
167 KIA 0.9059
168 CIT 0.9057
169 44W 0.9057
170 VK3 0.9057
171 B60 0.9057
172 B57 0.9056
173 IPZ 0.9055
174 TWO 0.9054
175 DOR 0.9053
176 M5N 0.9053
177 6R8 0.9051
178 8WT 0.9051
179 CWM 0.9051
180 OXC 0.9051
181 5WY 0.9050
182 M1H 0.9050
183 MEW 0.9050
184 6ME 0.9048
185 ORO 0.9047
186 44V 0.9047
187 HQY 0.9046
188 F1A 0.9045
189 HZQ 0.9045
190 5JL 0.9045
191 A2F 0.9045
192 R8V 0.9043
193 1NP 0.9043
194 AZ9 0.9043
195 5Q0 0.9042
196 5SG 0.9041
197 6AP 0.9041
198 HNQ 0.9041
199 GLY PRO 0.9040
200 NQ 0.9040
201 1LM 0.9040
202 5JQ 0.9040
203 1SQ 0.9038
204 QPR 0.9038
205 2H5 0.9037
206 24W 0.9037
207 ES1 0.9037
208 KJY 0.9037
209 290 0.9036
210 4TU 0.9036
211 5IQ 0.9032
212 0CU 0.9030
213 Q88 0.9029
214 V55 0.9027
215 0N7 0.9027
216 LKA 0.9026
217 4M4 0.9022
218 EUG 0.9022
219 DRL 0.9022
220 MAN 0.9021
221 HQD 0.9021
222 HA7 0.9019
223 G6D 0.9017
224 PRF 0.9017
225 DX4 0.9015
226 5MK 0.9015
227 5WX 0.9013
228 AEZ 0.9013
229 RXA 0.9013
230 CKX 0.9010
231 60Q 0.9010
232 N8Y 0.9010
233 ADK 0.9009
234 K3Q 0.9007
235 HMH 0.9007
236 S76 0.9005
237 EVA 0.9004
238 R9Y 0.9004
239 YSO 0.9004
240 GIO 0.9004
241 3MA 0.9003
242 GDE 0.9003
243 TRA 0.9002
244 HMU 0.9002
245 CFF 0.9001
246 C2U 0.9001
247 GNL 0.9001
248 39U 0.9000
249 SWA 0.8999
250 KBG 0.8998
251 8XQ 0.8996
252 XXR 0.8996
253 39A 0.8996
254 YH7 0.8996
255 37T 0.8994
256 2AL 0.8994
257 HHR 0.8993
258 O72 0.8993
259 PH2 0.8993
260 34D 0.8992
261 HTP 0.8990
262 AJV 0.8990
263 BOA 0.8990
264 2FQ 0.8990
265 M1E 0.8988
266 7HQ 0.8986
267 MAQ 0.8985
268 ZWZ 0.8985
269 K2P 0.8983
270 3C1 0.8983
271 1P7 0.8981
272 7WR 0.8979
273 NOJ 0.8979
274 4NO 0.8979
275 FE DB1 0.8978
276 4V6 0.8977
277 3C2 0.8976
278 3DO 0.8975
279 ZVO 0.8974
280 J01 0.8973
281 6GU 0.8972
282 3Z7 0.8971
283 MT8 0.8970
284 GLA 0.8969
285 24B 0.8967
286 ZZT 0.8967
287 G1O 0.8966
288 06B 0.8966
289 HH5 0.8965
290 NDH 0.8964
291 GCW 0.8962
292 LT8 0.8962
293 IV2 0.8960
294 DHQ 0.8955
295 5NS 0.8955
296 DHK 0.8954
297 GIM 0.8953
298 BTE 0.8952
299 091 0.8951
300 25W 0.8951
301 FLV 0.8951
302 149 0.8950
303 5NE 0.8950
304 948 0.8949
305 8W9 0.8949
306 3M0 0.8948
307 V6F 0.8948
308 2FY 0.8947
309 SKM 0.8947
310 EYK 0.8946
311 WOO 0.8944
312 AW5 0.8943
313 15L 0.8942
314 JUG 0.8940
315 HH8 0.8940
316 PFB 0.8940
317 CTL 0.8938
318 2AK 0.8936
319 32X 0.8935
320 MO8 0.8934
321 209 0.8933
322 3WA 0.8933
323 CLZ 0.8931
324 FDB 0.8931
325 5RN 0.8929
326 Z5P 0.8928
327 SAL 0.8926
328 2FG 0.8925
329 H33 0.8925
330 ALL 0.8923
331 UAN 0.8923
332 KFH 0.8922
333 PQ0 0.8920
334 JBQ 0.8920
335 M6N 0.8919
336 FBT 0.8918
337 7M6 0.8917
338 VNL 0.8916
339 4XH 0.8916
340 1WD 0.8913
341 1DW 0.8912
342 2A9 0.8912
343 FUC 0.8910
344 BEA 0.8910
345 4HM 0.8910
346 CN0 0.8910
347 GTL 0.8910
348 8GK 0.8909
349 G2F 0.8909
350 226 0.8909
351 EV0 0.8909
352 12M 0.8909
353 MS9 0.8907
354 GLT 0.8906
355 TTL 0.8904
356 B53 0.8904
357 CTS 0.8904
358 BE2 0.8902
359 DBH 0.8901
360 3F0 0.8901
361 HPA 0.8899
362 ISE 0.8899
363 5VJ 0.8898
364 6VD 0.8898
365 N8P 0.8898
366 3HA 0.8897
367 ICO 0.8897
368 4SV 0.8896
369 3U4 0.8896
370 6XI 0.8896
371 KBB 0.8896
372 HHT 0.8895
373 F6P 0.8894
374 DMJ 0.8892
375 7A3 0.8892
376 5RO 0.8892
377 PDC 0.8892
378 FH2 0.8891
379 DNF 0.8890
380 TEP 0.8889
381 FDK 0.8889
382 D1X 0.8889
383 GRE 0.8889
384 GIV 0.8888
385 QQQ 0.8887
386 3R6 0.8886
387 TOF 0.8884
388 PRZ 0.8883
389 GCB 0.8882
390 JTH 0.8881
391 2A7 0.8881
392 F0J 0.8879
393 J9W 0.8879
394 AMG 0.8879
395 NOY 0.8877
396 6F0 0.8877
397 293 0.8876
398 BPU 0.8874
399 12Q 0.8870
400 GTR 0.8868
401 67X 0.8867
402 II6 0.8867
403 8H8 0.8866
404 XQ0 0.8864
405 9KT 0.8864
406 86J 0.8863
407 3DM 0.8861
408 ADA 0.8859
409 ES6 0.8858
410 X6X 0.8858
411 GCV 0.8857
412 M1Q 0.8857
413 4AA 0.8857
414 GSY 0.8856
415 ADE 0.8855
416 GAF 0.8854
417 8WO 0.8854
418 39O 0.8852
419 QM1 0.8851
420 BCP 0.8850
421 FPK 0.8850
422 IFL 0.8846
423 2HQ 0.8846
424 NGO 0.8846
425 7WV 0.8845
426 EA1 0.8844
427 A65 0.8844
428 7ME 0.8844
429 MHK 0.8843
430 7HP 0.8841
431 TTY 0.8841
432 5QX 0.8839
433 JKE 0.8838
434 PFL 0.8833
435 CKU 0.8832
436 MVL 0.8832
437 HKD 0.8831
438 KJH 0.8831
439 2KA 0.8830
440 9HX 0.8828
441 JXN 0.8826
442 VNJ 0.8825
443 3MB 0.8825
444 EXO 0.8825
445 DNC 0.8824
446 F5B 0.8823
447 NSP 0.8822
448 AUD 0.8822
449 ODO 0.8821
450 JND 0.8819
451 XYP 0.8818
452 SOR 0.8818
453 0FK 0.8818
454 DIU 0.8818
455 1GN 0.8818
456 2ZV 0.8818
457 SYV 0.8817
458 ZZ3 0.8817
459 HLD 0.8817
460 GXY 0.8814
461 6M1 0.8812
462 SVN 0.8812
463 7WA 0.8811
464 2J9 0.8811
465 7B3 0.8810
466 5B1 0.8809
467 9DA 0.8809
468 7D2 0.8809
469 BP1 0.8809
470 TFU 0.8808
471 OMD 0.8807
472 FDR 0.8806
473 LT2 0.8805
474 ASO 0.8805
475 10L 0.8804
476 7W1 0.8803
477 8ZE 0.8802
478 MCO 0.8802
479 ISN 0.8802
480 MT5 0.8800
481 6MP 0.8797
482 BK9 0.8797
483 EPR 0.8797
484 A13 0.8794
485 JXW 0.8791
486 92K 0.8791
487 P4B 0.8789
488 OA3 0.8788
489 GZL 0.8787
490 FUL 0.8787
491 6LW 0.8783
492 DIE 0.8783
493 SWD 0.8782
494 HQT 0.8782
495 OTD 0.8780
496 HHA 0.8780
497 JKZ 0.8780
498 4ZC 0.8779
499 X05 0.8778
500 X8D 0.8777
501 ICT 0.8776
502 FRU 0.8775
503 LI6 0.8775
504 LZ2 0.8774
505 5PX 0.8772
506 TH7 0.8771
507 SOE 0.8768
508 GYE 0.8768
509 F05 0.8768
510 LZM 0.8767
511 ES5 0.8765
512 NAG 0.8764
513 23A 0.8764
514 NBG 0.8762
515 03V 0.8761
516 C9E 0.8761
517 0LH 0.8761
518 INS 0.8760
519 KKN 0.8760
520 AX3 0.8760
521 X09 0.8758
522 EQT 0.8758
523 H6B 0.8757
524 NGT 0.8756
525 KP6 0.8755
526 F31 0.8755
527 PA1 0.8754
528 OCH 0.8753
529 6BL 0.8752
530 4XV 0.8751
531 GV9 0.8751
532 COU 0.8743
533 2AQ 0.8743
534 0GZ 0.8741
535 FHN 0.8741
536 FGZ 0.8740
537 5OB 0.8739
538 82I 0.8738
539 RM1 0.8738
540 AH8 0.8736
541 9AP 0.8736
542 SKA 0.8736
543 MNM 0.8734
544 AHR 0.8733
545 DEE 0.8733
546 XQG 0.8733
547 EMZ 0.8731
548 5WU 0.8730
549 RPQ 0.8730
550 JBE 0.8727
551 1U6 0.8726
552 JB5 0.8726
553 S3B 0.8724
554 LDR 0.8724
555 ES4 0.8723
556 12T 0.8723
557 92P 0.8722
558 JR2 0.8721
559 3ID 0.8720
560 9EW 0.8718
561 3HB 0.8718
562 4CS 0.8717
563 HBO 0.8717
564 PM6 0.8715
565 QIC 0.8712
566 IFM 0.8709
567 K17 0.8709
568 G3E 0.8708
569 SR4 0.8708
570 4JT 0.8707
571 6M9 0.8707
572 4JQ 0.8707
573 FB1 0.8706
574 GXL 0.8705
575 M2K 0.8705
576 XQB 0.8703
577 QX2 0.8703
578 4XS 0.8702
579 1X7 0.8701
580 FBU 0.8699
581 ASC 0.8698
582 7W4 0.8698
583 NVU 0.8697
584 RAM 0.8697
585 JU2 0.8697
586 SYR 0.8697
587 YIO 0.8696
588 LCN 0.8695
589 3GQ 0.8694
590 SHA 0.8694
591 IPM 0.8694
592 MMA 0.8692
593 QWW 0.8691
594 H5B 0.8690
595 ZYR 0.8690
596 M1A 0.8690
597 67N 0.8688
598 FBV 0.8687
599 1WG 0.8686
600 2K8 0.8685
601 B2J 0.8684
602 4FS 0.8683
603 0FN 0.8682
604 PHH 0.8682
605 TBS 0.8681
606 EOL 0.8680
607 9R5 0.8679
608 5QY 0.8677
609 18N 0.8676
610 FSW 0.8676
611 4AV 0.8675
612 TIU 0.8674
613 0XT 0.8673
614 42A 0.8670
615 8HC 0.8670
616 9PY 0.8670
617 DFB 0.8669
618 7I2 0.8668
619 95Z 0.8666
620 ES7 0.8662
621 PEY 0.8661
622 BZ3 0.8661
623 AVR 0.8660
624 IL5 0.8658
625 E35 0.8657
626 HLR 0.8657
627 C2Y 0.8655
628 1KP 0.8654
629 2LY 0.8649
630 2CQ 0.8649
631 H7Y 0.8646
632 XQK 0.8646
633 FP1 0.8646
634 DMD 0.8643
635 3FH 0.8642
636 BDF 0.8641
637 H42 0.8639
638 KYA 0.8638
639 4KL 0.8637
640 BCF 0.8636
641 5WV 0.8636
642 F81 0.8635
643 HFB 0.8634
644 VXX 0.8632
645 BBF 0.8630
646 HHS 0.8630
647 DQN 0.8630
648 X0W 0.8628
649 3NT 0.8628
650 GYP 0.8627
651 PEZ 0.8626
652 JZ3 0.8623
653 5GU 0.8622
654 G4D 0.8621
655 GAB 0.8619
656 FBB 0.8619
657 DGJ 0.8618
658 AFR 0.8618
659 3AB 0.8618
660 OXZ 0.8617
661 MQN 0.8617
662 JIF 0.8617
663 KTW 0.8612
664 M0Q 0.8609
665 8NX 0.8608
666 0TU 0.8605
667 0RW 0.8603
668 5HN 0.8602
669 JG8 0.8599
670 FCB 0.8597
671 W81 0.8597
672 SE2 0.8596
673 OVV 0.8594
674 KGK 0.8593
675 4YO 0.8589
676 2CK 0.8588
677 4VS 0.8587
678 JF1 0.8586
679 QUZ 0.8585
680 MFU 0.8585
681 NPY 0.8583
682 KYD 0.8580
683 2CZ 0.8574
684 K22 0.8574
685 8MO 0.8573
686 WCE 0.8573
687 CBF 0.8571
688 61O 0.8569
689 ABV 0.8568
690 H62 0.8565
691 7MU 0.8564
692 TGX 0.8560
693 RM4 0.8556
694 43M 0.8555
695 9BZ 0.8552
696 ET2 0.8550
697 P3K 0.8550
698 NK 0.8548
699 XYD 0.8547
700 CDV 0.8541
701 JYB 0.8537
702 BRT 0.8537
703 4XR 0.8537
704 MSN 0.8533
705 TDR 0.8527
706 286 0.8525
707 RNS 0.8523
708 2ZM 0.8520
709 SF6 0.8519
710 F4Z 0.8517
711 BSP 0.8516
712 TH0 0.8515
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 5F33; Ligand: PGH; 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: 5f33.bio1) has 20 residues
No: Leader PDB Ligand Sequence Similarity
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