Receptor
PDB id Resolution Class Description Source Keywords
6F48 1.5 Å EC: 2.5.1.72 STRUCTURE OF QUINOLINATE SYNTHASE WITH REACTION INTERMEDIATE THERMOTOGA MARITIMA NAD BIOSYNTHESIS IRON SULFUR CLUSTER TRANSFERASE
Ref.: CRYSTALLOGRAPHIC TRAPPING OF REACTION INTERMEDIATES QUINOLINIC ACID SYNTHESIS BY NADA. ACS CHEM. BIOL. V. 13 1209 2018
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...
XQB A:302;
 Valid;
 none;
 submit data
203.149 C7 H9 N O6 [H]/N...
GOL A:303;
 Invalid;
 none;
 submit data
92.094 C3 H8 O3 C(C(C...
YQA A:305;
 Valid;
 none;
 submit data
185.134 C7 H7 N O5 C1[C@...
CL A:306;
A:304;
 Invalid;
Invalid;
 none;
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: XQB; Similar ligands found: 1
No: Ligand ECFP6 Tc MDL keys Tc
1 XQB 1 1
Ligand no: 2; Ligand: YQA; Similar ligands found: 1
No: Ligand ECFP6 Tc MDL keys Tc
1 YQA 1 1
Similar Ligands (3D)
Ligand no: 1; Ligand: XQB; Similar ligands found: 70
No: Ligand Similarity coefficient
1 ATH 0.9532
2 ICT 0.9469
3 EKN 0.9374
4 TRA 0.9311
5 5UK 0.9280
6 CIT 0.9278
7 FLC 0.9257
8 GLY LEU 0.9221
9 NCD 0.9155
10 7A2 0.9114
11 7A3 0.9112
12 HCA 0.9094
13 KJM 0.9063
14 NZ3 0.9059
15 MIC 0.9051
16 0FA 0.9034
17 HMQ 0.9022
18 CDT 0.9014
19 TRC 0.8993
20 AVO 0.8981
21 NLQ 0.8949
22 SER THR 0.8939
23 GLY ASP 0.8921
24 KDO 0.8919
25 5XW 0.8919
26 CCB 0.8919
27 1AL 0.8910
28 NQM 0.8908
29 NTC 0.8905
30 HJ7 0.8892
31 256 0.8888
32 NIG 0.8883
33 791 0.8878
34 87L 0.8874
35 HCT 0.8861
36 DER 0.8859
37 AVI 0.8852
38 GTC 0.8849
39 3MF 0.8844
40 NLG 0.8841
41 7QD 0.8836
42 AOR 0.8831
43 5XR 0.8818
44 G01 0.8811
45 7UZ 0.8810
46 M72 0.8810
47 AIN 0.8786
48 GBN 0.8784
49 NBB 0.8778
50 PRE 0.8764
51 7UC 0.8754
52 OTD 0.8751
53 NFQ 0.8746
54 LX1 0.8743
55 ALA LEU 0.8718
56 GZ8 0.8704
57 QAS 0.8703
58 PCV 0.8669
59 SKM 0.8662
60 G88 0.8637
61 DMO 0.8623
62 GM7 0.8620
63 YQA 0.8619
64 GLY MET 0.8611
65 CUW 0.8610
66 CDV 0.8592
67 K2P 0.8583
68 AN0 0.8569
69 4WK 0.8552
70 MIG 0.8530
Ligand no: 2; Ligand: YQA; Similar ligands found: 655
No: Ligand Similarity coefficient
1 GZ8 0.9962
2 QAS 0.9936
3 GM7 0.9896
4 GJS 0.9830
5 QAT 0.9820
6 PHT 0.9776
7 KLW 0.9740
8 LSA 0.9730
9 NTM 0.9706
10 SXS 0.9614
11 EJZ 0.9560
12 ZZ8 0.9480
13 3MG 0.9403
14 NCD 0.9383
15 KT7 0.9377
16 UEG 0.9377
17 URC 0.9352
18 G3F 0.9334
19 BGC 0.9326
20 APZ 0.9321
21 54G 0.9318
22 4TE 0.9307
23 GCS 0.9306
24 PXL 0.9302
25 8TX 0.9295
26 GOG 0.9290
27 Q71 0.9286
28 GTQ 0.9284
29 5RG 0.9282
30 0P6 0.9269
31 MWP 0.9269
32 B55 0.9258
33 20J 0.9257
34 VOH 0.9257
35 1AL 0.9253
36 AIN 0.9253
37 2ZQ 0.9250
38 3Z8 0.9246
39 5M0 0.9244
40 8S0 0.9243
41 1U1 0.9242
42 9MG 0.9242
43 G5V 0.9240
44 GLC 0.9239
45 9TZ 0.9232
46 4HC 0.9228
47 HXX 0.9218
48 PX7 0.9217
49 9DG 0.9215
50 GAL 0.9212
51 DBX 0.9204
52 QBK 0.9199
53 60Q 0.9199
54 ENL 0.9195
55 7ZE 0.9194
56 GLY PRO 0.9193
57 Q24 0.9189
58 NDM 0.9186
59 3IT 0.9185
60 QX4 0.9184
61 M0Q 0.9177
62 F12 0.9177
63 J9W 0.9174
64 Q7A 0.9169
65 1XN 0.9167
66 1LQ 0.9166
67 2MN 0.9164
68 AZ8 0.9163
69 LGC 0.9161
70 5CU 0.9160
71 5MK 0.9159
72 5NU 0.9159
73 FOT 0.9159
74 75K 0.9158
75 AQO 0.9158
76 AJ2 0.9157
77 FA0 0.9156
78 AZA 0.9154
79 0W8 0.9149
80 ORO 0.9148
81 HLZ 0.9148
82 XAN 0.9148
83 PE0 0.9148
84 M6N 0.9148
85 UNC 0.9146
86 XAZ 0.9145
87 M3S 0.9145
88 MEW 0.9142
89 6CS 0.9140
90 M5K 0.9138
91 A7W 0.9133
92 B5D 0.9132
93 FBG 0.9131
94 BTY 0.9130
95 GHM 0.9127
96 GUN 0.9127
97 OXC 0.9127
98 BDP 0.9127
99 5JQ 0.9125
100 IGA 0.9124
101 141 0.9121
102 329 0.9119
103 4M0 0.9117
104 MUA 0.9117
105 PXM 0.9116
106 290 0.9112
107 ICT 0.9111
108 GT0 0.9107
109 N5J 0.9107
110 AZG 0.9105
111 D07 0.9105
112 M1Q 0.9104
113 FLC 0.9103
114 KIB 0.9102
115 HQD 0.9102
116 8CM 0.9101
117 IJZ 0.9098
118 M1H 0.9098
119 M5N 0.9098
120 7VS 0.9098
121 Q6T 0.9098
122 TRC 0.9096
123 12B 0.9093
124 NID 0.9091
125 495 0.9091
126 SHG 0.9089
127 JBH 0.9088
128 JPZ 0.9088
129 CWS 0.9087
130 CFP 0.9087
131 2D0 0.9086
132 3C2 0.9085
133 6M4 0.9085
134 DBJ 0.9085
135 HJP 0.9084
136 DIN 0.9084
137 DOB 0.9084
138 680 0.9083
139 KUF 0.9080
140 TRA 0.9078
141 3WA 0.9077
142 091 0.9076
143 8IG 0.9076
144 GCV 0.9075
145 HNQ 0.9075
146 A2F 0.9074
147 VNL 0.9074
148 4YS 0.9073
149 Q88 0.9072
150 6AP 0.9068
151 5WX 0.9067
152 GLA 0.9064
153 1SQ 0.9063
154 7VJ 0.9062
155 MT0 0.9060
156 5JL 0.9060
157 3C1 0.9060
158 TTL 0.9059
159 ES1 0.9057
160 INE 0.9056
161 DQU 0.9056
162 VK3 0.9055
163 3TJ 0.9055
164 5SG 0.9055
165 5IQ 0.9054
166 D3M 0.9054
167 M0W 0.9053
168 MRW 0.9051
169 24W 0.9049
170 5WY 0.9049
171 AKH 0.9048
172 BMA 0.9048
173 CIT 0.9047
174 1XM 0.9047
175 2EC 0.9046
176 1NP 0.9046
177 O72 0.9046
178 5Q0 0.9046
179 7A2 0.9046
180 DX4 0.9044
181 XHP 0.9044
182 4ME 0.9043
183 DRL 0.9042
184 KFH 0.9041
185 HQY 0.9041
186 ES0 0.9040
187 KIA 0.9039
188 CWM 0.9038
189 V55 0.9037
190 UFO 0.9037
191 1LM 0.9037
192 BHA 0.9036
193 FYU 0.9036
194 FLV 0.9036
195 7B4 0.9035
196 4MU 0.9035
197 V6F 0.9034
198 7HQ 0.9034
199 6GU 0.9033
200 6R8 0.9033
201 RXA 0.9032
202 MO8 0.9028
203 F1A 0.9028
204 7NI 0.9027
205 IPB 0.9027
206 I3A 0.9026
207 39U 0.9026
208 SX1 0.9025
209 8XQ 0.9022
210 R8V 0.9020
211 GCU 0.9020
212 K2P 0.9019
213 OTW 0.9017
214 ZB1 0.9017
215 ADK 0.9014
216 3M0 0.9013
217 GCB 0.9011
218 GCW 0.9010
219 NTZ 0.9010
220 SRO 0.9010
221 LT8 0.9008
222 44V 0.9007
223 C2U 0.9005
224 FBT 0.9005
225 42C 0.9003
226 TEP 0.9003
227 HZQ 0.9001
228 GIM 0.9000
229 8WT 0.9000
230 6ME 0.8998
231 DBH 0.8996
232 YH7 0.8994
233 3F0 0.8993
234 HMU 0.8993
235 DPZ 0.8991
236 I6G 0.8991
237 2H5 0.8990
238 GDE 0.8990
239 0FO 0.8990
240 KBB 0.8988
241 B62 0.8988
242 BOA 0.8987
243 EUG 0.8986
244 0CU 0.8986
245 4M4 0.8986
246 E7Z 0.8984
247 AEZ 0.8984
248 AZ9 0.8984
249 GTZ 0.8984
250 5QX 0.8981
251 3MA 0.8980
252 FPK 0.8980
253 BTE 0.8979
254 S76 0.8978
255 EYK 0.8978
256 LKA 0.8978
257 NLQ 0.8976
258 DOR 0.8968
259 DHK 0.8965
260 NQ 0.8963
261 NOJ 0.8962
262 MBG 0.8961
263 7WR 0.8961
264 MVN 0.8960
265 2A9 0.8959
266 QQQ 0.8959
267 8GK 0.8959
268 5RO 0.8958
269 44W 0.8958
270 B60 0.8957
271 0N7 0.8956
272 MHK 0.8956
273 5NS 0.8955
274 HTP 0.8955
275 F0J 0.8955
276 34D 0.8954
277 JKE 0.8954
278 2AK 0.8953
279 4V6 0.8953
280 HMH 0.8951
281 SAL 0.8950
282 2AL 0.8950
283 EVA 0.8948
284 06B 0.8947
285 BE2 0.8947
286 4TU 0.8947
287 2A7 0.8947
288 PRF 0.8946
289 1WD 0.8946
290 HH5 0.8945
291 ATH 0.8944
292 2FY 0.8942
293 ZWZ 0.8941
294 MAN 0.8939
295 6XI 0.8939
296 QPR 0.8937
297 YSO 0.8937
298 BCP 0.8936
299 Z5P 0.8936
300 JTH 0.8935
301 MAQ 0.8933
302 2FG 0.8932
303 24B 0.8931
304 AMG 0.8930
305 ZZT 0.8929
306 5RN 0.8929
307 AW5 0.8928
308 J01 0.8925
309 ADZ 0.8923
310 JKZ 0.8923
311 NTC 0.8921
312 G2F 0.8921
313 HPA 0.8920
314 1GN 0.8919
315 NGO 0.8919
316 RPQ 0.8917
317 HH8 0.8916
318 SWA 0.8915
319 6VD 0.8915
320 TWO 0.8914
321 N8P 0.8914
322 CKX 0.8913
323 PYQ 0.8912
324 3HA 0.8909
325 JND 0.8908
326 KJY 0.8907
327 B57 0.8905
328 4NO 0.8904
329 JBQ 0.8903
330 Q77 0.8903
331 4Z4 0.8902
332 CTS 0.8902
333 5VJ 0.8902
334 OA3 0.8900
335 PRZ 0.8900
336 ICO 0.8899
337 4HM 0.8899
338 HA7 0.8899
339 4XH 0.8899
340 XQ0 0.8897
341 7A3 0.8896
342 8VE 0.8895
343 AH8 0.8893
344 SYV 0.8886
345 MVL 0.8886
346 NSP 0.8885
347 K3Q 0.8884
348 NOY 0.8883
349 DHQ 0.8883
350 CN0 0.8880
351 CLZ 0.8877
352 3Z7 0.8875
353 4AA 0.8875
354 DNF 0.8875
355 DNC 0.8875
356 IFL 0.8875
357 3R6 0.8874
358 39A 0.8874
359 2KA 0.8872
360 UAN 0.8872
361 FDK 0.8872
362 67X 0.8872
363 15L 0.8871
364 CFF 0.8870
365 GIV 0.8870
366 GOX 0.8870
367 VNJ 0.8870
368 D1X 0.8870
369 B53 0.8870
370 DIE 0.8866
371 SKM 0.8865
372 FRU 0.8865
373 149 0.8865
374 12M 0.8865
375 GTR 0.8862
376 3SK 0.8859
377 JUG 0.8859
378 8W9 0.8858
379 7WV 0.8857
380 3DM 0.8856
381 HKD 0.8856
382 ASO 0.8855
383 FDB 0.8855
384 G1O 0.8854
385 5NE 0.8854
386 3U4 0.8853
387 BK9 0.8853
388 ADE 0.8848
389 6F0 0.8847
390 82I 0.8847
391 FH2 0.8847
392 AS3 0.8847
393 6LW 0.8846
394 NDH 0.8845
395 7HP 0.8845
396 PFB 0.8844
397 FE DB1 0.8840
398 SLC 0.8839
399 32X 0.8839
400 PFL 0.8838
401 GIO 0.8837
402 AUD 0.8835
403 II6 0.8833
404 37T 0.8832
405 0LH 0.8832
406 ALL 0.8831
407 ES6 0.8831
408 HHR 0.8831
409 PH2 0.8831
410 92K 0.8831
411 MS9 0.8830
412 7ME 0.8829
413 SR4 0.8828
414 PQ0 0.8827
415 23A 0.8824
416 MT8 0.8824
417 HLD 0.8823
418 2FQ 0.8821
419 226 0.8821
420 A13 0.8821
421 9HX 0.8820
422 GSY 0.8820
423 IP0 0.8819
424 GYE 0.8819
425 X6X 0.8817
426 FUC 0.8817
427 ODO 0.8817
428 SVN 0.8817
429 0FK 0.8816
430 QM1 0.8814
431 BEA 0.8814
432 R9Y 0.8813
433 TTY 0.8813
434 F6P 0.8813
435 IV2 0.8813
436 FB1 0.8809
437 PDC 0.8806
438 MIC 0.8805
439 EV0 0.8804
440 LZM 0.8802
441 EA1 0.8800
442 M1E 0.8799
443 9DA 0.8798
444 42A 0.8798
445 209 0.8796
446 8H8 0.8796
447 4SV 0.8796
448 3DO 0.8795
449 293 0.8794
450 G6D 0.8791
451 12Q 0.8791
452 CTL 0.8789
453 GRE 0.8788
454 F31 0.8787
455 LCN 0.8787
456 8WO 0.8787
457 TOF 0.8787
458 9KT 0.8786
459 N8Y 0.8786
460 1P7 0.8786
461 DIU 0.8784
462 0GZ 0.8783
463 7W1 0.8782
464 4ZC 0.8777
465 95Z 0.8775
466 KBG 0.8773
467 10L 0.8773
468 948 0.8773
469 7WA 0.8773
470 HHT 0.8769
471 XX3 0.8769
472 NFQ 0.8769
473 ZZ3 0.8768
474 LT2 0.8768
475 7D2 0.8767
476 BP1 0.8766
477 SKA 0.8765
478 6MP 0.8763
479 GXY 0.8762
480 LZ2 0.8762
481 GV9 0.8760
482 1DW 0.8760
483 TH7 0.8760
484 6M1 0.8758
485 FHN 0.8756
486 BPU 0.8753
487 X8D 0.8751
488 KKN 0.8750
489 AX3 0.8747
490 ISN 0.8746
491 WOO 0.8746
492 SWD 0.8745
493 X09 0.8744
494 F05 0.8743
495 2D3 0.8740
496 GAF 0.8740
497 GZL 0.8739
498 YIO 0.8737
499 C2Y 0.8737
500 PM6 0.8736
501 H33 0.8736
502 HQT 0.8736
503 NVU 0.8735
504 MNM 0.8734
505 4JT 0.8729
506 4XV 0.8728
507 TFU 0.8728
508 AHR 0.8728
509 GTL 0.8725
510 7B3 0.8724
511 RM1 0.8724
512 39O 0.8723
513 LDR 0.8723
514 OTD 0.8721
515 FUL 0.8720
516 7W4 0.8716
517 X05 0.8716
518 X0W 0.8712
519 3ID 0.8710
520 BHO 0.8709
521 1U6 0.8707
522 ZVO 0.8706
523 03V 0.8706
524 86J 0.8705
525 ADA 0.8705
526 CBF 0.8705
527 PA1 0.8704
528 M2K 0.8704
529 FBU 0.8704
530 GLT 0.8703
531 ZZZ 0.8701
532 EMZ 0.8701
533 G3E 0.8700
534 A65 0.8699
535 LI6 0.8699
536 2J9 0.8697
537 QX2 0.8695
538 ES4 0.8693
539 XQK 0.8693
540 2CK 0.8692
541 1KP 0.8691
542 EXO 0.8690
543 K17 0.8689
544 1X7 0.8688
545 3MB 0.8688
546 P3K 0.8686
547 0FN 0.8686
548 2ZV 0.8686
549 KP6 0.8684
550 GXL 0.8684
551 2LY 0.8683
552 5PX 0.8683
553 6BL 0.8683
554 9EW 0.8683
555 QWW 0.8682
556 JXW 0.8682
557 3HB 0.8681
558 SJ5 0.8680
559 9AP 0.8680
560 F81 0.8679
561 61O 0.8677
562 AFR 0.8676
563 DFB 0.8676
564 LFR 0.8676
565 ASC 0.8675
566 XQG 0.8674
567 4AV 0.8671
568 JR2 0.8671
569 FBV 0.8667
570 IFM 0.8667
571 C9E 0.8667
572 7M6 0.8666
573 12T 0.8666
574 O2A 0.8665
575 4FS 0.8664
576 FGZ 0.8662
577 5WU 0.8662
578 SHA 0.8661
579 7I2 0.8659
580 AVR 0.8659
581 NGT 0.8658
582 FDR 0.8658
583 6M9 0.8657
584 COU 0.8656
585 GLF 0.8655
586 5QY 0.8654
587 ES7 0.8653
588 S3B 0.8653
589 EQT 0.8653
590 DMJ 0.8653
591 H42 0.8651
592 DMD 0.8648
593 GYP 0.8648
594 4XS 0.8647
595 MMA 0.8645
596 5WV 0.8642
597 FSW 0.8641
598 UQ 0.8640
599 OCH 0.8639
600 M1A 0.8637
601 EOL 0.8637
602 5OB 0.8636
603 67N 0.8636
604 E35 0.8632
605 4JQ 0.8629
606 JB5 0.8627
607 TVP 0.8627
608 DQN 0.8625
609 JXN 0.8620
610 URF 0.8620
611 XQB 0.8619
612 H6B 0.8618
613 3GQ 0.8614
614 J9Q 0.8613
615 KYA 0.8613
616 MCO 0.8610
617 MT5 0.8610
618 B2J 0.8609
619 DEE 0.8608
620 KOJ 0.8607
621 BZ3 0.8607
622 97T 0.8607
623 3AL 0.8599
624 PEZ 0.8598
625 G4D 0.8598
626 GAB 0.8597
627 JZ3 0.8596
628 3NT 0.8594
629 2AQ 0.8594
630 8NX 0.8592
631 ES5 0.8591
632 OVV 0.8590
633 7MH 0.8589
634 18N 0.8588
635 5B1 0.8586
636 IUP 0.8579
637 OXZ 0.8579
638 NK 0.8576
639 9BZ 0.8568
640 0RW 0.8566
641 L3Q 0.8565
642 SF6 0.8565
643 5GU 0.8563
644 4A5 0.8559
645 286 0.8558
646 FCB 0.8557
647 TIU 0.8556
648 3AB 0.8555
649 F5B 0.8551
650 DGJ 0.8551
651 4KL 0.8548
652 KYD 0.8548
653 0R0 0.8544
654 NPY 0.8534
655 1F1 0.8532
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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