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Receptor

PDB id	Resolution	Class	Description	Source	Keywords
5HIO	1.9 Å	NON-ENZYME: OTHER	CRYSTAL STRUCTURE OF PQS RESPONSE PROTEIN PQSE IN COMPLEX WI AMINOBENZOYLACETATE	PSEUDOMONAS AERUGINOSA PAO1	QUORUM SENSING PQS PQSE INHIBITOR PSEUDOMONAS METAL BINPROTEIN
Ref.:	DISSECTING THE MULTIPLE ROLES OF PQSE IN PSEUDOMONA AERUGINOSA VIRULENCE BY DISCOVERY OF SMALL TOOL COM ACS CHEM.BIOL. V. 11 1755 2016

Ligand

Ligand	Chain:Residue	Validity	Ligand Warnings	Binding Data	NGL Viewer	Molecular Weight (Da)	Formula	SMILES
FE	A:401; A:402;	Part of Protein; Part of Protein;	none; none;	submit data		55.845	Fe	[Fe+3...
61M	A:403;	Valid;	none;	submit data		179.173	C9 H9 N O3	c1ccc...

View in 3D viewer

90% Homology Family

Leader

PDB id	Resolution	Class	Description	Source	Keywords
5HIP	1.99 Å	NON-ENZYME: OTHER	CRYSTAL STRUCTURE OF PQS RESPONSE PROTEIN PQSE IN COMPLEX WI (PYRIDIN-3-YL)BENZOIC ACID	PSEUDOMONAS AERUGINOSA PAO1	QUORUM SENSING PQS PQSE INHIBITOR PSEUDOMONAS METAL BINPROTEIN
Ref.:	DISSECTING THE MULTIPLE ROLES OF PQSE IN PSEUDOMONA AERUGINOSA VIRULENCE BY DISCOVERY OF SMALL TOOL COM ACS CHEM.BIOL. V. 11 1755 2016

Members (7)

No:	PDB id	Binding Data	Representative ligand	Formula	Smiles
The Class containing this family consists of a total of 1610 families.
1	5HIP	Kd = 0.9 uM	61O	C12 H9 N O2	c1ccc(c(c1....
2	2Q0I	Kd = 29.1 uM	BEZ	C7 H6 O2	c1ccc(cc1)....
3	3DH8	-	B4N	C12 H9 N2 O8 P	c1cc(ccc1[....
4	5HIO	-	61M	C9 H9 N O3	c1ccc(c(c1....
5	5HIS	Kd = 19.6 uM	60P	C6 H6 O2 S	Cc1ccsc1C(....
6	2Q0J	Kd = 29.1 uM	BEZ	C7 H6 O2	c1ccc(cc1)....
7	5HIQ	-	60Q	C11 H9 N O2	c1ccc(c(c1....

70% Homology Family (7)

No:	PDB id	Binding Data	Representative ligand	Formula	Smiles
The Class containing this family consists of a total of 1331 families.
1	5HIP	Kd = 0.9 uM	61O	C12 H9 N O2	c1ccc(c(c1....
2	2Q0I	Kd = 29.1 uM	BEZ	C7 H6 O2	c1ccc(cc1)....
3	3DH8	-	B4N	C12 H9 N2 O8 P	c1cc(ccc1[....
4	5HIO	-	61M	C9 H9 N O3	c1ccc(c(c1....
5	5HIS	Kd = 19.6 uM	60P	C6 H6 O2 S	Cc1ccsc1C(....
6	2Q0J	Kd = 29.1 uM	BEZ	C7 H6 O2	c1ccc(cc1)....
7	5HIQ	-	60Q	C11 H9 N O2	c1ccc(c(c1....

50% Homology Family (7)

No:	PDB id	Binding Data	Representative ligand	Formula	Smiles
The Class containing this family consists of a total of 1144 families.
1	5HIP	Kd = 0.9 uM	61O	C12 H9 N O2	c1ccc(c(c1....
2	2Q0I	Kd = 29.1 uM	BEZ	C7 H6 O2	c1ccc(cc1)....
3	3DH8	-	B4N	C12 H9 N2 O8 P	c1cc(ccc1[....
4	5HIO	-	61M	C9 H9 N O3	c1ccc(c(c1....
5	5HIS	Kd = 19.6 uM	60P	C6 H6 O2 S	Cc1ccsc1C(....
6	2Q0J	Kd = 29.1 uM	BEZ	C7 H6 O2	c1ccc(cc1)....
7	5HIQ	-	60Q	C11 H9 N O2	c1ccc(c(c1....

Polypharmacology

Similar Ligands (2D)

Ligand no: 1; Ligand: 61M; Similar ligands found: 4

No:	Ligand	ECFP6 Tc	MDL keys Tc
1	61M	1	1
2	BE2	0.542857	0.709677
3	KYN	0.522727	0.828571
4	92K	0.487179	0.78125

Similar Ligands (3D)

Ligand no: 1; Ligand: 61M; Similar ligands found: 1385

No:	Ligand	Similarity coefficient
1	P7Y	0.9735
2	TSR	0.9641
3	1A7	0.9620
4	MQB	0.9596
5	IAC	0.9590
6	CH9	0.9586
7	L22	0.9567
8	NVU	0.9563
9	PO6	0.9534
10	57O	0.9509
11	NPA	0.9502
12	APS	0.9492
13	23J	0.9492
14	F06	0.9490
15	7VP	0.9489
16	M5H	0.9486
17	M74	0.9485
18	PJW	0.9484
19	ESP	0.9483
20	ARP	0.9477
21	1F1	0.9474
22	IWT	0.9465
23	1L5	0.9464
24	KTW	0.9452
25	NLA	0.9448
26	GO2	0.9447
27	XIZ	0.9427
28	0QW	0.9424
29	ESX	0.9414
30	5VL	0.9410
31	R20	0.9410
32	MNP	0.9409
33	YZM	0.9408
34	BZ2	0.9407
35	3A9	0.9406
36	TCA	0.9403
37	DHY	0.9402
38	2K8	0.9399
39	KYA	0.9397
40	PPY	0.9396
41	363	0.9396
42	0HN	0.9394
43	6NT	0.9389
44	BNL	0.9387
45	9KH	0.9384
46	8NX	0.9379
47	CXP	0.9376
48	J9N	0.9373
49	IOS	0.9372
50	TSS	0.9371
51	8GK	0.9368
52	JRB	0.9364
53	0LH	0.9363
54	68A	0.9362
55	TT4	0.9361
56	SQ4	0.9354
57	9ZE	0.9352
58	ZON	0.9351
59	GZ2	0.9351
60	HA5	0.9350
61	1XA	0.9349
62	KMY	0.9347
63	AMR	0.9345
64	XDK	0.9341
65	E1T	0.9337
66	ICB	0.9337
67	MD6	0.9337
68	N1E	0.9336
69	M3Q	0.9335
70	92P	0.9334
71	SMN	0.9332
72	3R4	0.9331
73	5NI	0.9331
74	0HO	0.9330
75	15N	0.9328
76	BPY	0.9326
77	0JD	0.9324
78	M6H	0.9321
79	M5E	0.9317
80	OA3	0.9314
81	2ZM	0.9312
82	SLS	0.9304
83	PHE	0.9304
84	LNR	0.9304
85	2HC	0.9303
86	4I8	0.9302
87	5OO	0.9300
88	GVG	0.9300
89	2O6	0.9297
90	DNF	0.9297
91	ESI	0.9297
92	6ZX	0.9297
93	0NX	0.9296
94	2LY	0.9292
95	1VK	0.9292
96	0W1	0.9291
97	ZME	0.9290
98	L5V	0.9290
99	MAJ	0.9289
100	6FZ	0.9287
101	HL4	0.9287
102	4BY	0.9286
103	4LW	0.9285
104	3NY	0.9284
105	9RW	0.9284
106	091	0.9283
107	CFA	0.9282
108	LVD	0.9281
109	HC4	0.9280
110	ZYR	0.9279
111	SHA	0.9279
112	JB8	0.9277
113	HQJ	0.9277
114	N2Z	0.9276
115	52C	0.9276
116	HCI	0.9275
117	ABI	0.9270
118	MSR	0.9270
119	FXH	0.9269
120	L13	0.9269
121	TZM	0.9268
122	D8Q	0.9267
123	TB8	0.9267
124	JAW	0.9267
125	SRO	0.9267
126	N9J	0.9266
127	JDN	0.9264
128	N2M	0.9264
129	P80	0.9263
130	SV4	0.9262
131	8HC	0.9260
132	6NI	0.9260
133	92G	0.9258
134	C82	0.9257
135	0FK	0.9256
136	J9Q	0.9256
137	GRO	0.9256
138	HX4	0.9254
139	ABF	0.9253
140	6KT	0.9252
141	173	0.9252
142	FF2	0.9249
143	9FE	0.9248
144	ONR	0.9248
145	BCU	0.9247
146	DEE	0.9247
147	ZZ2	0.9245
148	5RN	0.9244
149	3ZB	0.9244
150	6TZ	0.9244
151	ICO	0.9243
152	R2P	0.9242
153	428	0.9238
154	2SX	0.9237
155	4RU	0.9237
156	9FL	0.9236
157	SDF	0.9236
158	C2Y	0.9235
159	QMS	0.9233
160	XEN	0.9231
161	3C4	0.9230
162	DHC	0.9230
163	OIA	0.9229
164	56D	0.9229
165	BZJ	0.9228
166	7MX	0.9228
167	CPZ	0.9228
168	EYV	0.9226
169	IOP	0.9226
170	22L	0.9226
171	8ZE	0.9225
172	2HU	0.9221
173	3HP	0.9221
174	HHS	0.9219
175	BQ2	0.9218
176	AOT	0.9216
177	46P	0.9214
178	B41	0.9213
179	SKF	0.9213
180	N2I	0.9212
181	FEH	0.9212
182	AHN	0.9211
183	790	0.9210
184	6J9	0.9210
185	BNF	0.9210
186	5F5	0.9209
187	NAG	0.9205
188	54X	0.9205
189	DPN	0.9205
190	A5P	0.9204
191	EVA	0.9204
192	97T	0.9203
193	FK8	0.9202
194	A5E	0.9201
195	HHH	0.9200
196	0F9	0.9199
197	NFM	0.9197
198	UNJ	0.9196
199	TMG	0.9196
200	36Y	0.9195
201	6Q3	0.9194
202	M4E	0.9193
203	JF2	0.9193
204	PD2	0.9192
205	MPV	0.9191
206	8U3	0.9190
207	TRP	0.9189
208	MP5	0.9187
209	HNH	0.9186
210	PBA	0.9184
211	4OG	0.9184
212	30G	0.9182
213	GJP	0.9182
214	S24	0.9182
215	ENO	0.9182
216	SNU	0.9181
217	2C2	0.9179
218	XCG	0.9179
219	C9E	0.9178
220	9UL	0.9178
221	BK9	0.9176
222	JP2	0.9176
223	SBK	0.9175
224	VM1	0.9175
225	J0Z	0.9174
226	EVF	0.9174
227	6DP	0.9174
228	XIY	0.9173
229	5XC	0.9173
230	A29	0.9172
231	ALE	0.9171
232	LL1	0.9171
233	9BF	0.9169
234	B09	0.9168
235	NFA	0.9167
236	R9Y	0.9167
237	12T	0.9166
238	2BG	0.9165
239	4VY	0.9164
240	PH2	0.9164
241	1IT	0.9162
242	V1T	0.9162
243	1QP	0.9161
244	HSX	0.9161
245	CLU	0.9160
246	1WC	0.9160
247	6HO	0.9159
248	BDP	0.9157
249	0FR	0.9156
250	FDR	0.9155
251	Z5P	0.9155
252	505	0.9154
253	269	0.9154
254	LDP	0.9154
255	4LV	0.9154
256	YTX	0.9152
257	2FX	0.9152
258	1M2	0.9152
259	XYH	0.9151
260	NOK	0.9151
261	P81	0.9151
262	2FY	0.9151
263	1BN	0.9151
264	PDC	0.9150
265	HHR	0.9148
266	3VW	0.9147
267	SAF	0.9147
268	F4E	0.9146
269	QUS	0.9144
270	36M	0.9144
271	S2P	0.9143
272	KTA	0.9143
273	MXN	0.9143
274	5RO	0.9142
275	OMD	0.9142
276	STT	0.9142
277	9CA	0.9141
278	2CZ	0.9141
279	4WL	0.9141
280	PEY	0.9140
281	3VX	0.9140
282	X48	0.9140
283	BGC	0.9140
284	GO8	0.9137
285	M2K	0.9135
286	MES	0.9135
287	BZ3	0.9135
288	1HN	0.9134
289	AMQ	0.9134
290	GCU	0.9133
291	TLM	0.9133
292	HXY	0.9132
293	HA7	0.9131
294	4XF	0.9130
295	RM1	0.9129
296	AX3	0.9128
297	5OB	0.9127
298	5TY	0.9126
299	4Z3	0.9125
300	RUY	0.9125
301	JXZ	0.9124
302	PBN	0.9123
303	EXD	0.9122
304	MS9	0.9121
305	DI6	0.9120
306	ITW	0.9120
307	Q02	0.9120
308	5WZ	0.9119
309	7I2	0.9118
310	CK2	0.9118
311	S7G	0.9117
312	TZP	0.9117
313	BZE	0.9117
314	535	0.9117
315	FIX	0.9116
316	5OF	0.9115
317	8XL	0.9114
318	HPP	0.9114
319	LGC	0.9113
320	J6W	0.9112
321	FTV	0.9112
322	TOH	0.9111
323	PIM	0.9111
324	TYR	0.9110
325	DTY	0.9110
326	RA7	0.9110
327	A3M	0.9109
328	TYL	0.9109
329	PFF	0.9108
330	55D	0.9106
331	264	0.9106
332	AHC	0.9106
333	BP7	0.9105
334	HBO	0.9105
335	DTR	0.9105
336	BB4	0.9104
337	268	0.9104
338	GVY	0.9103
339	J4K	0.9103
340	GLO	0.9102
341	F69	0.9102
342	7VS	0.9100
343	LZ2	0.9098
344	ZZZ	0.9098
345	HDH	0.9098
346	8G0	0.9096
347	PPT	0.9096
348	4XV	0.9094
349	OW7	0.9094
350	MHK	0.9093
351	BHO	0.9093
352	4HP	0.9092
353	F52	0.9092
354	N8Y	0.9091
355	S0W	0.9091
356	AAN	0.9091
357	H5B	0.9090
358	NCT	0.9090
359	GDL	0.9089
360	EQA	0.9086
361	TU0	0.9086
362	I1E	0.9086
363	EN1	0.9086
364	JTH	0.9086
365	XDE	0.9085
366	R8Y	0.9085
367	OGA	0.9085
368	JF6	0.9085
369	I3A	0.9084
370	YOF	0.9084
371	EGR	0.9083
372	F90	0.9083
373	27B	0.9082
374	HFA	0.9082
375	MXD	0.9082
376	HNL	0.9081
377	8WT	0.9080
378	2GQ	0.9080
379	3H2	0.9079
380	DAH	0.9079
381	B85	0.9079
382	ISZ	0.9078
383	TYC	0.9077
384	NIZ	0.9077
385	BY5	0.9077
386	MR1	0.9076
387	M3H	0.9076
388	XFE	0.9076
389	DNA	0.9076
390	8S0	0.9076
391	FCD	0.9075
392	I2E	0.9075
393	ZZA	0.9075
394	LFC	0.9073
395	MNN	0.9073
396	SHI	0.9072
397	6FB	0.9072
398	SYE	0.9071
399	6VD	0.9071
400	MPK	0.9071
401	DXG	0.9070
402	KTJ	0.9070
403	263	0.9069
404	5WU	0.9069
405	ATX	0.9068
406	NYL	0.9068
407	OOG	0.9067
408	N91	0.9066
409	4ME	0.9065
410	50C	0.9065
411	HWD	0.9064
412	PH3	0.9063
413	G6P	0.9063
414	8WO	0.9063
415	DC5	0.9063
416	QPR	0.9062
417	GXG	0.9062
418	YIE	0.9062
419	4XS	0.9061
420	GLR	0.9061
421	DEZ	0.9060
422	1DJ	0.9059
423	LSQ	0.9058
424	PLP	0.9057
425	8OZ	0.9057
426	258	0.9057
427	GCB	0.9057
428	6J5	0.9056
429	JG8	0.9056
430	HQ9	0.9056
431	ZEC	0.9056
432	MMS	0.9056
433	2ZQ	0.9056
434	X0U	0.9054
435	KDG	0.9054
436	4TU	0.9053
437	1SV	0.9053
438	45L	0.9052
439	4KL	0.9051
440	E35	0.9051
441	M0Q	0.9051
442	5LA	0.9050
443	FHC	0.9050
444	SLY	0.9050
445	8NB	0.9049
446	3TC	0.9049
447	GWM	0.9048
448	NBG	0.9047
449	TQU	0.9047
450	E1P	0.9046
451	JND	0.9046
452	A9P	0.9046
453	YF3	0.9044
454	M45	0.9043
455	PQT	0.9043
456	LDR	0.9042
457	2F6	0.9042
458	5NS	0.9041
459	EDR	0.9041
460	8W9	0.9041
461	P58	0.9040
462	GZL	0.9039
463	VNL	0.9038
464	67Y	0.9038
465	9AP	0.9037
466	AKG	0.9035
467	KF5	0.9035
468	4P5	0.9035
469	D3G	0.9034
470	CUW	0.9033
471	VXX	0.9033
472	JF1	0.9033
473	HHI	0.9033
474	FUD	0.9033
475	R9M	0.9032
476	E7Z	0.9031
477	Q03	0.9030
478	G14	0.9030
479	TZF	0.9029
480	M1Z	0.9028
481	KJU	0.9028
482	M0W	0.9028
483	PRA	0.9027
484	PSJ	0.9027
485	HNK	0.9027
486	2LP	0.9026
487	3BU	0.9026
488	JR2	0.9024
489	FWD	0.9024
490	H4E	0.9023
491	PRZ	0.9023
492	9PY	0.9023
493	DRG	0.9022
494	5WN	0.9022
495	49O	0.9020
496	RD4	0.9019
497	AEH	0.9019
498	INO	0.9019
499	RMN	0.9019
500	CUT	0.9019
501	DNC	0.9017
502	5GT	0.9017
503	EOL	0.9017
504	36E	0.9016
505	HJH	0.9013
506	SYC	0.9013
507	YPN	0.9012
508	R9S	0.9012
509	3QO	0.9012
510	F12	0.9011
511	069	0.9011
512	S7A	0.9011
513	QIV	0.9011
514	5GU	0.9011
515	78U	0.9010
516	LTN	0.9010
517	67X	0.9009
518	AY4	0.9009
519	Y3L	0.9009
520	28N	0.9009
521	2D8	0.9008
522	QBM	0.9008
523	795	0.9008
524	B40	0.9008
525	GCO	0.9007
526	4BL	0.9006
527	N4B	0.9006
528	E7S	0.9006
529	DHK	0.9005
530	OTR	0.9004
531	GXD	0.9004
532	I59	0.9003
533	EYJ	0.9003
534	BZQ	0.9003
535	94W	0.9002
536	B4O	0.9002
537	CFI	0.9001
538	ISA	0.8999
539	5NE	0.8999
540	PLR	0.8999
541	CSN	0.8998
542	1Z6	0.8998
543	DEW	0.8997
544	3R6	0.8997
545	3IL	0.8997
546	UFO	0.8996
547	L99	0.8995
548	BRH	0.8995
549	C53	0.8995
550	0BP	0.8994
551	S0E	0.8994
552	GLC	0.8993
553	FPL	0.8993
554	EUE	0.8992
555	1SS	0.8992
556	2HG	0.8992
557	ISD	0.8991
558	DDU	0.8990
559	LZM	0.8990
560	FA3	0.8990
561	5XB	0.8989
562	F9Y	0.8988
563	TOM	0.8988
564	3MB	0.8987
565	5WY	0.8987
566	XQI	0.8987
567	ASC	0.8987
568	2EC	0.8987
569	0OL	0.8987
570	BG6	0.8986
571	AN3	0.8984
572	ODO	0.8984
573	SG2	0.8983
574	11C	0.8983
575	3YP	0.8982
576	33S	0.8982
577	0P6	0.8982
578	FZM	0.8981
579	1X4	0.8980
580	D6G	0.8980
581	RNO	0.8980
582	HIS	0.8979
583	SOR	0.8979
584	P9E	0.8978
585	4BF	0.8978
586	LEL	0.8977
587	4PN	0.8977
588	GOJ	0.8977
589	PMP	0.8977
590	7HQ	0.8976
591	PTU	0.8976
592	GDE	0.8975
593	GAL	0.8975
594	DHB	0.8974
595	CK1	0.8973
596	9F8	0.8971
597	MJ5	0.8971
598	GC2	0.8970
599	GZQ	0.8970
600	SNO	0.8970
601	CH8	0.8970
602	EYY	0.8969
603	7FF	0.8969
604	TIH	0.8968
605	EV3	0.8968
606	M3E	0.8967
607	CCB	0.8966
608	M6Z	0.8966
609	7ZL	0.8966
610	344	0.8965
611	OVM	0.8965
612	6L6	0.8965
613	89J	0.8965
614	KDV	0.8963
615	9R5	0.8963
616	TL6	0.8963
617	28S	0.8962
618	CLT	0.8962
619	5O5	0.8962
620	CKA	0.8960
621	3LR	0.8959
622	F34	0.8958
623	SSC	0.8958
624	CXH	0.8958
625	4R1	0.8957
626	Q04	0.8957
627	OA1	0.8957
628	6ME	0.8956
629	B21	0.8956
630	4ZA	0.8956
631	GNM	0.8955
632	IYR	0.8955
633	M6P	0.8955
634	OHP	0.8955
635	YIH	0.8955
636	THA	0.8954
637	QX4	0.8954
638	NID	0.8953
639	TYE	0.8951
640	RLG	0.8950
641	PUE	0.8949
642	3Z8	0.8949
643	L14	0.8948
644	4JQ	0.8947
645	MTL	0.8946
646	CTL	0.8946
647	4AV	0.8945
648	LTT	0.8945
649	93K	0.8945
650	IBM	0.8945
651	TXW	0.8943
652	NQH	0.8943
653	ETV	0.8943
654	DXK	0.8943
655	XI7	0.8942
656	5JT	0.8940
657	327	0.8940
658	5F8	0.8940
659	7WR	0.8939
660	BSX	0.8939
661	FER	0.8939
662	PNZ	0.8939
663	4Z9	0.8938
664	9SE	0.8938
665	EQW	0.8937
666	A6P	0.8936
667	DE5	0.8936
668	M4T	0.8936
669	PMF	0.8936
670	PHI	0.8935
671	CIY	0.8933
672	FLV	0.8933
673	DAL DAL	0.8932
674	E4P	0.8931
675	RP5	0.8931
676	BGP	0.8930
677	GJZ	0.8929
678	KBG	0.8929
679	54G	0.8929
680	GCS	0.8928
681	N7I	0.8927
682	CLZ	0.8927
683	AEG	0.8926
684	N3W	0.8926
685	CWD	0.8926
686	42A	0.8926
687	M1E	0.8926
688	GLN	0.8925
689	4V2	0.8925
690	IHB	0.8925
691	J9T	0.8924
692	5FL	0.8924
693	6XI	0.8924
694	RJY	0.8923
695	7ME	0.8923
696	AVI	0.8923
697	S8V	0.8922
698	15L	0.8921
699	DUR	0.8921
700	O2Y	0.8920
701	HKD	0.8920
702	2KA	0.8920
703	H4B	0.8919
704	CHB	0.8918
705	4FA	0.8918
706	AM4	0.8917
707	URC	0.8917
708	GLU	0.8917
709	EWG	0.8916
710	3Y7	0.8915
711	H7Y	0.8915
712	SQV	0.8915
713	AEF	0.8914
714	2AL	0.8914
715	42J	0.8914
716	A7W	0.8914
717	MB1	0.8913
718	0A9	0.8913
719	S2G	0.8912
720	CWJ	0.8912
721	S3C	0.8912
722	1LN	0.8912
723	THM	0.8911
724	HNQ	0.8911
725	2KU	0.8910
726	DIN	0.8910
727	M1H	0.8910
728	IPD	0.8908
729	27K	0.8907
730	PZP	0.8907
731	D1Y	0.8907
732	3CR	0.8906
733	DHI	0.8905
734	9TW	0.8905
735	C0H	0.8905
736	AOS	0.8904
737	F31	0.8903
738	BWD	0.8903
739	PYU	0.8903
740	LT1	0.8903
741	8XQ	0.8903
742	SHG	0.8902
743	NGT	0.8902
744	GTQ	0.8902
745	61O	0.8901
746	EKZ	0.8900
747	YE6	0.8900
748	LTM	0.8900
749	IWD	0.8900
750	V55	0.8900
751	41K	0.8900
752	FHB	0.8899
753	GB5	0.8899
754	CC5	0.8898
755	4MU	0.8898
756	Q9Z	0.8898
757	BEA	0.8897
758	FBM	0.8897
759	PRF	0.8897
760	FA1	0.8896
761	B3U	0.8896
762	DQU	0.8895
763	LYL	0.8895
764	5MK	0.8895
765	DCZ	0.8894
766	JZA	0.8894
767	2BX	0.8893
768	FGZ	0.8892
769	TGX	0.8892
770	SYV	0.8892
771	SYM	0.8892
772	7MU	0.8892
773	7QS	0.8892
774	PAC	0.8891
775	JZ4	0.8891
776	HDL	0.8890
777	MS0	0.8890
778	FP1	0.8890
779	CIP	0.8890
780	PCS	0.8889
781	8TX	0.8889
782	261	0.8889
783	5HY	0.8888
784	7ZE	0.8888
785	42C	0.8888
786	RAT	0.8887
787	657	0.8887
788	4ZD	0.8887
789	7O4	0.8887
790	LQ2	0.8886
791	7AP	0.8885
792	CWS	0.8885
793	FBF	0.8884
794	CTE	0.8884
795	J9W	0.8884
796	UFV	0.8883
797	SQ7	0.8883
798	7Q1	0.8882
799	LPK	0.8880
800	TTY	0.8880
801	HPT	0.8880
802	MIG	0.8880
803	EXL	0.8878
804	GTR	0.8878
805	ZSP	0.8877
806	2HO	0.8877
807	PIY	0.8876
808	KUF	0.8876
809	A5H	0.8876
810	DGL	0.8875
811	LJ3	0.8875
812	3LJ	0.8874
813	QSH	0.8874
814	PRO GLY	0.8874
815	INE	0.8873
816	4JT	0.8873
817	S0G	0.8873
818	M02	0.8871
819	PZI	0.8871
820	Q24	0.8871
821	EPR	0.8870
822	B86	0.8870
823	3AL	0.8869
824	L21	0.8869
825	492	0.8868
826	3PG	0.8868
827	K97	0.8867
828	HPS	0.8867
829	QH3	0.8867
830	78Y	0.8867
831	F9P	0.8866
832	3QM	0.8866
833	2LT	0.8866
834	W29	0.8866
835	HLZ	0.8865
836	P9P	0.8865
837	YO5	0.8864
838	GLP	0.8863
839	6QF	0.8863
840	UAN	0.8863
841	KP2	0.8862
842	QY9	0.8862
843	4CM	0.8861
844	4SX	0.8860
845	PQ0	0.8860
846	BBK	0.8859
847	EV0	0.8859
848	4BZ	0.8858
849	K3Q	0.8858
850	BPU	0.8857
851	TNX	0.8857
852	X11	0.8857
853	TVP	0.8856
854	549	0.8855
855	ORO	0.8855
856	APZ	0.8855
857	Q6T	0.8854
858	SSB	0.8854
859	A9O	0.8854
860	SOL	0.8853
861	5M0	0.8853
862	IJZ	0.8853
863	OW4	0.8852
864	BL0	0.8852
865	CS2	0.8852
866	96Z	0.8851
867	ANC	0.8851
868	LZ5	0.8851
869	ONZ	0.8850
870	H2B	0.8847
871	0W8	0.8847
872	3EB	0.8847
873	4HC	0.8847
874	E7R	0.8847
875	PHU	0.8846
876	4NB	0.8846
877	5O6	0.8846
878	THU	0.8845
879	ANF	0.8845
880	KPA	0.8845
881	ARG	0.8845
882	AMH	0.8844
883	2QC	0.8844
884	BPW	0.8843
885	GF4	0.8843
886	HBI	0.8842
887	4NZ	0.8842
888	4YO	0.8842
889	HF2	0.8841
890	ANN	0.8841
891	K7M	0.8840
892	XQG	0.8839
893	M6D	0.8839
894	3GV	0.8839
895	PRY	0.8839
896	M1Q	0.8839
897	4NC	0.8838
898	14W	0.8838
899	AA	0.8838
900	4FP	0.8838
901	6HP	0.8837
902	YRL	0.8837
903	DX3	0.8836
904	E9S	0.8836
905	0XT	0.8836
906	ZYV	0.8835
907	GV9	0.8835
908	EMZ	0.8834
909	LYS	0.8833
910	UA5	0.8832
911	4Z4	0.8832
912	ZYQ	0.8831
913	MRW	0.8831
914	TAG	0.8831
915	NGW	0.8831
916	3IT	0.8831
917	X0V	0.8830
918	UN1	0.8829
919	F5C	0.8829
920	SEP	0.8829
921	F4K	0.8829
922	GJK	0.8828
923	HJ7	0.8827
924	C1M	0.8826
925	NGO	0.8826
926	MYI	0.8825
927	HIC	0.8825
928	4AB	0.8823
929	RVE	0.8823
930	B55	0.8822
931	M3P	0.8821
932	A7H	0.8820
933	GAE	0.8820
934	BHQ	0.8820
935	3VQ	0.8820
936	KT7	0.8820
937	GGL	0.8819
938	2IT	0.8819
939	DBJ	0.8818
940	7OD	0.8818
941	AS3	0.8818
942	WOE	0.8818
943	NDG	0.8817
944	4FE	0.8817
945	BIO	0.8816
946	4AA	0.8816
947	DGN	0.8816
948	MUC	0.8816
949	GC3	0.8815
950	KP6	0.8815
951	2JK	0.8814
952	XRS	0.8814
953	X04	0.8814
954	K4V	0.8813
955	OCH	0.8813
956	ZIQ	0.8812
957	T2D	0.8812
958	9RH	0.8812
959	2UZ	0.8810
960	QMP	0.8810
961	PXP	0.8810
962	2UD	0.8810
963	1PS	0.8809
964	7MW	0.8809
965	0N7	0.8808
966	G1P	0.8808
967	1Z8	0.8808
968	0FN	0.8807
969	AKH	0.8807
970	SDD	0.8807
971	717	0.8806
972	4A3	0.8805
973	DOR	0.8805
974	MOK	0.8805
975	XHP	0.8804
976	DHR	0.8803
977	ZHA	0.8803
978	HRM	0.8803
979	L03	0.8803
980	5RG	0.8803
981	KFH	0.8803
982	2UB	0.8802
983	CX4	0.8801
984	HHT	0.8801
985	HMS	0.8800
986	ROI	0.8800
987	FOT	0.8800
988	QSB	0.8799
989	2JJ	0.8798
990	HQD	0.8798
991	1P8	0.8798
992	XX2	0.8797
993	LOG	0.8797
994	2C0	0.8797
995	GZV	0.8797
996	KBB	0.8797
997	GRF	0.8796
998	A7K	0.8796
999	0DN	0.8795
1000	OQC	0.8795
1001	DIE	0.8795
1002	EA1	0.8794
1003	COU	0.8794
1004	8VN	0.8794
1005	M78	0.8793
1006	MYJ	0.8792
1007	LGT	0.8792
1008	ES2	0.8790
1009	I4D	0.8790
1010	A2G	0.8790
1011	3AE	0.8790
1012	5V7	0.8789
1013	H42	0.8789
1014	B56	0.8788
1015	RES	0.8788
1016	D2G	0.8788
1017	ASO	0.8788
1018	BQ5	0.8788
1019	1AL	0.8787
1020	NAL	0.8787
1021	IPT	0.8786
1022	MZM	0.8785
1023	JB5	0.8785
1024	BPN	0.8785
1025	GT4	0.8784
1026	JLZ	0.8783
1027	DQA	0.8783
1028	TPA	0.8782
1029	0FO	0.8781
1030	S8D	0.8780
1031	4A5	0.8780
1032	AC2	0.8780
1033	K80	0.8779
1034	15E	0.8777
1035	0TU	0.8776
1036	EUG	0.8776
1037	9W5	0.8775
1038	MCY	0.8774
1039	B1J	0.8774
1040	JFJ	0.8774
1041	JVN	0.8774
1042	HJ8	0.8774
1043	3VS	0.8773
1044	TWO	0.8772
1045	RP3	0.8771
1046	ES5	0.8771
1047	BGU	0.8771
1048	GHM	0.8770
1049	MWP	0.8770
1050	848	0.8769
1051	LAO	0.8769
1052	DYT	0.8768
1053	EXR	0.8768
1054	RNS	0.8768
1055	ICT	0.8768
1056	E79	0.8767
1057	4NS	0.8767
1058	DIG	0.8767
1059	P84	0.8765
1060	3HM	0.8764
1061	ENG	0.8763
1062	6R8	0.8762
1063	AZM	0.8762
1064	OSB	0.8762
1065	I3E	0.8761
1066	2AQ	0.8761
1067	W8G	0.8760
1068	4FS	0.8760
1069	03V	0.8759
1070	K6H	0.8757
1071	NNO	0.8757
1072	OVP	0.8754
1073	DIR	0.8754
1074	39O	0.8753
1075	0GZ	0.8752
1076	DHS	0.8752
1077	44V	0.8752
1078	A13	0.8752
1079	LT2	0.8751
1080	U7E	0.8751
1081	5MD	0.8750
1082	692	0.8750
1083	SWX	0.8749
1084	80G	0.8749
1085	3RI	0.8748
1086	URO	0.8748
1087	8GL	0.8747
1088	LIP	0.8745
1089	MJ2	0.8744
1090	SJK	0.8744
1091	XRX	0.8743
1092	JXW	0.8742
1093	FBB	0.8740
1094	7CT	0.8739
1095	7UC	0.8739
1096	8MO	0.8739
1097	ODK	0.8739
1098	ALN	0.8738
1099	BHS	0.8738
1100	JCZ	0.8738
1101	8CM	0.8737
1102	3MG	0.8737
1103	NFZ	0.8736
1104	IV2	0.8736
1105	EUH	0.8736
1106	DBX	0.8736
1107	2HQ	0.8736
1108	ONH	0.8733
1109	293	0.8733
1110	4NM	0.8733
1111	3QV	0.8732
1112	6RQ	0.8730
1113	0A1	0.8730
1114	ZEA	0.8730
1115	4NP	0.8730
1116	DA4	0.8729
1117	2PV	0.8729
1118	F0J	0.8728
1119	BTM	0.8728
1120	4M4	0.8727
1121	REL	0.8727
1122	IFP	0.8727
1123	FBU	0.8727
1124	75K	0.8727
1125	F1X	0.8727
1126	S60	0.8726
1127	E5X	0.8726
1128	IL5	0.8725
1129	XAZ	0.8724
1130	HNT	0.8724
1131	GLT	0.8724
1132	HLP	0.8723
1133	C0W	0.8722
1134	QME	0.8722
1135	4FH	0.8721
1136	7MK	0.8720
1137	2FQ	0.8720
1138	3PF	0.8720
1139	NGA	0.8720
1140	5LD	0.8719
1141	5AE	0.8719
1142	6BL	0.8719
1143	TCR	0.8718
1144	DER	0.8717
1145	FC2	0.8717
1146	S7J	0.8717
1147	DJN	0.8716
1148	4TP	0.8715
1149	ADA	0.8714
1150	3IB	0.8714
1151	CTN	0.8713
1152	ST3	0.8713
1153	KED	0.8712
1154	L7T	0.8712
1155	B62	0.8711
1156	JXK	0.8710
1157	7R4	0.8710
1158	NDH	0.8710
1159	SYA	0.8709
1160	GB4	0.8709
1161	DTE	0.8709
1162	CCV	0.8709
1163	NHG	0.8709
1164	CR1	0.8709
1165	N0Z	0.8709
1166	SKM	0.8708
1167	O2A	0.8707
1168	QIC	0.8705
1169	S8A	0.8705
1170	40F	0.8705
1171	LLH	0.8704
1172	3N1	0.8704
1173	GGB	0.8704
1174	PFL	0.8704
1175	1FE	0.8703
1176	BA5	0.8703
1177	4HM	0.8703
1178	RNT	0.8702
1179	IFG	0.8702
1180	F98	0.8702
1181	ID2	0.8702
1182	6MW	0.8702
1183	DLT	0.8702
1184	TJM	0.8701
1185	B2J	0.8701
1186	5GV	0.8700
1187	9GP	0.8700
1188	5DL	0.8699
1189	GNW	0.8699
1190	JBZ	0.8699
1191	5AD	0.8698
1192	IFL	0.8697
1193	TTL	0.8697
1194	JOV	0.8695
1195	GSY	0.8695
1196	I4B	0.8694
1197	PJL	0.8694
1198	I38	0.8693
1199	IPO	0.8693
1200	HLD	0.8692
1201	226	0.8692
1202	SR1	0.8690
1203	ZRK	0.8690
1204	TIU	0.8689
1205	CN0	0.8689
1206	BEU	0.8688
1207	KGK	0.8686
1208	BVA	0.8686
1209	7C3	0.8685
1210	JYT	0.8685
1211	RSV	0.8685
1212	86L	0.8684
1213	F16	0.8683
1214	GRX	0.8683
1215	3DM	0.8683
1216	K5W	0.8682
1217	LR2	0.8682
1218	60Q	0.8681
1219	BSA	0.8681
1220	9B3	0.8680
1221	1KP	0.8680
1222	URI	0.8679
1223	5QY	0.8679
1224	2P3	0.8678
1225	BVS	0.8678
1226	HG3	0.8677
1227	LDC	0.8677
1228	0OK	0.8677
1229	512	0.8676
1230	E0O	0.8676
1231	FWB	0.8676
1232	5QX	0.8676
1233	M72	0.8675
1234	7B3	0.8674
1235	3B4	0.8673
1236	SOV	0.8673
1237	K34	0.8673
1238	RBJ	0.8672
1239	AVA	0.8670
1240	EYA	0.8670
1241	XXG	0.8669
1242	X6P	0.8668
1243	2PK	0.8666
1244	MEW	0.8665
1245	HSO	0.8664
1246	PE0	0.8664
1247	MQN	0.8663
1248	2TU	0.8662
1249	3XH	0.8662
1250	SN4	0.8662
1251	0SY	0.8661
1252	2D0	0.8660
1253	A7N	0.8660
1254	3XR	0.8659
1255	G3E	0.8658
1256	D9Z	0.8658
1257	E3X	0.8658
1258	F6P	0.8657
1259	5VJ	0.8657
1260	LLT	0.8656
1261	8IG	0.8655
1262	3HG	0.8655
1263	GI3	0.8653
1264	HY1	0.8653
1265	MCO	0.8652
1266	XCZ	0.8652
1267	K25	0.8651
1268	CXF	0.8650
1269	CMU	0.8649
1270	BTY	0.8649
1271	K82	0.8649
1272	KOJ	0.8649
1273	ALL	0.8649
1274	URS	0.8648
1275	1ZC	0.8648
1276	2FG	0.8648
1277	82I	0.8647
1278	3SU	0.8647
1279	H7S	0.8647
1280	209	0.8647
1281	YIP	0.8646
1282	X0W	0.8645
1283	AM1	0.8645
1284	86J	0.8643
1285	D1X	0.8643
1286	X1P	0.8643
1287	ZZ8	0.8642
1288	259	0.8642
1289	1QV	0.8641
1290	CWM	0.8640
1291	LL2	0.8640
1292	5VU	0.8640
1293	EV2	0.8640
1294	Q71	0.8639
1295	Q88	0.8639
1296	ZXD	0.8639
1297	D48	0.8638
1298	B5D	0.8638
1299	XM0	0.8638
1300	SME	0.8637
1301	FBW	0.8636
1302	ROR	0.8635
1303	2LW	0.8633
1304	LR5	0.8632
1305	R9J	0.8631
1306	SD4	0.8630
1307	2L3	0.8630
1308	RB5	0.8629
1309	M5K	0.8624
1310	44W	0.8624
1311	GFP	0.8624
1312	NOY	0.8623
1313	PKU	0.8622
1314	E1K	0.8622
1315	N4E	0.8622
1316	4FF	0.8620
1317	54D	0.8619
1318	K68	0.8618
1319	SX1	0.8618
1320	5TZ	0.8617
1321	GIV	0.8616
1322	KW8	0.8615
1323	AH8	0.8615
1324	JV4	0.8615
1325	54Z	0.8614
1326	AMS	0.8614
1327	4JC	0.8613
1328	4TB	0.8612
1329	R8V	0.8612
1330	NBV	0.8611
1331	JAH	0.8611
1332	AJ2	0.8611
1333	0LO	0.8609
1334	EYM	0.8608
1335	R1P	0.8608
1336	DZA	0.8608
1337	CHQ	0.8607
1338	FF3	0.8606
1339	NSG	0.8606
1340	2V0	0.8606
1341	DBS	0.8605
1342	M4S	0.8604
1343	NLQ	0.8603
1344	4M0	0.8603
1345	5E5	0.8601
1346	JMG	0.8601
1347	20J	0.8601
1348	MO8	0.8600
1349	AES	0.8600
1350	3FH	0.8599
1351	BHA	0.8598
1352	HNM	0.8597
1353	AQO	0.8596
1354	FA0	0.8594
1355	OHJ	0.8592
1356	IQ5	0.8590
1357	NCV	0.8589
1358	8D6	0.8588
1359	6ZW	0.8587
1360	Z13	0.8586
1361	AZ8	0.8585
1362	TR7	0.8584
1363	3D8	0.8583
1364	JYW	0.8581
1365	RUJ	0.8580
1366	DRL	0.8578
1367	AOJ	0.8577
1368	8WZ	0.8572
1369	JTA	0.8569
1370	4CS	0.8565
1371	CEG	0.8564
1372	JYK	0.8555
1373	FBS	0.8553
1374	5PX	0.8550
1375	MET	0.8550
1376	2J9	0.8548
1377	BZM	0.8546
1378	FDK	0.8546
1379	4MB	0.8541
1380	BM3	0.8534
1381	FA6	0.8527
1382	AJD	0.8519
1383	JKZ	0.8518
1384	Y4L	0.8518
1385	GOX	0.8513

Similar Binding Sites (Proteins are less than 50% similar to leader)

Pocket No.: 1; Query (leader) PDB : 5HIP; Ligand: 61O; 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: 5hip.bio1) has 23 residues
No:	Leader PDB	Ligand	Sequence Similarity

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