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Receptor

PDB id	Resolution	Class	Description	Source	Keywords
5h4i	2 Å	EC: 3.4.21.91	UNLINKED NS2B-NS3 PROTEASE FROM ZIKA VIRUS IN COMPLEX WITH A FRAGMENT	ZIKA VIRUS	ZIKA VIRUS PROTEASE SERINE PROTEASE NON-STRUCTURAL PROTEINPROTEIN
Ref.:	CRYSTAL STRUCTURE OF UNLINKED NS2B-NS3 PROTEASE FRO VIRUS SCIENCE V. 354 1597 2016

Ligand

Ligand	Chain:Residue	Validity	Ligand Warnings	Binding Data	NGL Viewer	Molecular Weight (Da)	Formula	SMILES
7HQ	B:201;	Valid;	none;	submit data		148.162	C8 H8 N2 O	c1ccc...
ACT	B:202;	Invalid;	none;	submit data		59.044	C2 H3 O2	CC(=O...

View in 3D viewer

90% Homology Family

Leader

PDB id	Resolution	Class	Description	Source	Keywords
6Y3B	1.59 Å	EC: 3.4.21.91	CRYSTAL STRUCTURE OF UNLINKED NS2B-NS3 PROTEASE FROM ZIKA VI COMPLEX WITH INHIBITOR MI-2110	ZIKA VIRUS	FLAVIVIRIN SERINE PROTEASE VIRAL PROTEIN NS2B-NS3 ZIKA V
Ref.:	STRUCTURE-BASED MACROCYCLIZATION OF SUBSTRATE ANALO NS2B-NS3 PROTEASE INHIBITORS OF ZIKA, WEST NILE AND VIRUSES. CHEMMEDCHEM V. 15 1439 2020

Members (11)

No:	PDB id	Binding Data	Representative ligand	Formula	Smiles
The Class containing this family consists of a total of 8 families.
1	6L50	-	E60	C3 H3 N O S2	C1C(=O)NC(....
2	6KK2	-	D9U	C32 H54 N10 O5	[H]/N=C(N)....
3	5ZOB	-	2UE ARG ARG ARG 00S	n/a	n/a
4	5H4I	-	7HQ	C8 H8 N2 O	c1ccc2c(c1....
5	6KK4	-	DE0	C31 H52 N10 O5	[H]/N=C(/N....
6	6KK5	-	DE6	C31 H52 N10 O5	[H]/N=C(/N....
7	5ZMQ	-	PAC DLY DLY DAR	n/a	n/a
8	6Y3B	-	O7N	C30 H50 N10 O5	[H]/N=C(/N....
9	6JPW	-	SER C0F GLY LYS ARG LYS	n/a	n/a
10	6KK6	-	DV0	C31 H52 N10 O5	[H]/N=C(/N....
11	5ZMS	-	2UE DLY LYS DAR	n/a	n/a

70% Homology Family (12)

No:	PDB id	Binding Data	Representative ligand	Formula	Smiles
The Class containing this family consists of a total of 5 families.
1	6L50	-	E60	C3 H3 N O S2	C1C(=O)NC(....
2	6KK2	-	D9U	C32 H54 N10 O5	[H]/N=C(N)....
3	5ZOB	-	2UE ARG ARG ARG 00S	n/a	n/a
4	5H4I	-	7HQ	C8 H8 N2 O	c1ccc2c(c1....
5	6KK4	-	DE0	C31 H52 N10 O5	[H]/N=C(/N....
6	6KK5	-	DE6	C31 H52 N10 O5	[H]/N=C(/N....
7	5ZMQ	-	PAC DLY DLY DAR	n/a	n/a
8	6Y3B	-	O7N	C30 H50 N10 O5	[H]/N=C(/N....
9	6JPW	-	SER C0F GLY LYS ARG LYS	n/a	n/a
10	6KK6	-	DV0	C31 H52 N10 O5	[H]/N=C(/N....
11	5ZMS	-	2UE DLY LYS DAR	n/a	n/a
12	6KK3	-	DUU	C32 H54 N10 O5	[H]/N=C(N)....

50% Homology Family (13)

No:	PDB id	Binding Data	Representative ligand	Formula	Smiles
The Class containing this family consists of a total of 4 families.
1	6L50	-	E60	C3 H3 N O S2	C1C(=O)NC(....
2	6KK2	-	D9U	C32 H54 N10 O5	[H]/N=C(N)....
3	5ZOB	-	2UE ARG ARG ARG 00S	n/a	n/a
4	5H4I	-	7HQ	C8 H8 N2 O	c1ccc2c(c1....
5	6KK4	-	DE0	C31 H52 N10 O5	[H]/N=C(/N....
6	6KK5	-	DE6	C31 H52 N10 O5	[H]/N=C(/N....
7	5ZMQ	-	PAC DLY DLY DAR	n/a	n/a
8	6Y3B	-	O7N	C30 H50 N10 O5	[H]/N=C(/N....
9	6JPW	-	SER C0F GLY LYS ARG LYS	n/a	n/a
10	6KK6	-	DV0	C31 H52 N10 O5	[H]/N=C(/N....
11	5ZMS	-	2UE DLY LYS DAR	n/a	n/a
12	3U1I	Ki = 5.6 uM	BEZ NLE LYS ARG OAR	n/a	n/a
13	6KK3	-	DUU	C32 H54 N10 O5	[H]/N=C(N)....

Polypharmacology

Similar Ligands (2D)

Ligand no: 1; Ligand: 7HQ; Similar ligands found: 1

No:	Ligand	ECFP6 Tc	MDL keys Tc
1	7HQ	1	1

Similar Ligands (3D)

Ligand no: 1; Ligand: 7HQ; Similar ligands found: 1275

No:	Ligand	Similarity coefficient
1	I3A	1.0000
2	RM1	0.9998
3	LZM	0.9885
4	42A	0.9868
5	M0W	0.9795
6	5OB	0.9787
7	0RW	0.9771
8	9EW	0.9766
9	SVN	0.9764
10	ICO	0.9759
11	6M4	0.9745
12	COU	0.9745
13	F05	0.9743
14	HLR	0.9738
15	HLZ	0.9737
16	4FS	0.9735
17	2AQ	0.9734
18	1LM	0.9732
19	2EC	0.9730
20	5RN	0.9729
21	G3F	0.9726
22	7VS	0.9723
23	BZ3	0.9715
24	SAL	0.9712
25	H42	0.9711
26	1LQ	0.9710
27	6M9	0.9710
28	JB5	0.9709
29	JBE	0.9705
30	N5J	0.9703
31	GUN	0.9698
32	03V	0.9697
33	DBJ	0.9695
34	HH8	0.9694
35	TSS	0.9694
36	AZA	0.9692
37	XAN	0.9690
38	M0Q	0.9687
39	JBH	0.9687
40	1XN	0.9686
41	M2K	0.9686
42	JPZ	0.9685
43	BGC	0.9684
44	8S0	0.9684
45	0W8	0.9683
46	M1E	0.9683
47	MEW	0.9682
48	9DG	0.9681
49	OCH	0.9679
50	ES5	0.9679
51	1NP	0.9678
52	GLC	0.9677
53	J9W	0.9673
54	1SQ	0.9672
55	4YS	0.9672
56	O72	0.9668
57	1P7	0.9666
58	4XH	0.9664
59	ES1	0.9664
60	PE0	0.9664
61	SWD	0.9660
62	IGA	0.9659
63	ADE	0.9656
64	AZ8	0.9656
65	5IQ	0.9655
66	3DO	0.9654
67	M1H	0.9651
68	AHR	0.9649
69	7HP	0.9648
70	PM6	0.9646
71	5RG	0.9641
72	6AP	0.9641
73	L3Q	0.9640
74	BZX	0.9639
75	6MP	0.9638
76	24W	0.9638
77	A2F	0.9638
78	141	0.9638
79	MR1	0.9636
80	F9Y	0.9634
81	GCS	0.9632
82	JAE	0.9632
83	Q24	0.9631
84	HPA	0.9629
85	BP1	0.9628
86	XQG	0.9628
87	Q6T	0.9626
88	5MB	0.9625
89	ES4	0.9624
90	5H1	0.9624
91	5Q0	0.9621
92	BE2	0.9615
93	5SG	0.9614
94	14O	0.9610
95	AKH	0.9609
96	HQY	0.9607
97	M1Q	0.9605
98	F60	0.9605
99	9MG	0.9604
100	RSF	0.9603
101	5WX	0.9602
102	ES9	0.9601
103	9DA	0.9599
104	AJ2	0.9598
105	6AI	0.9597
106	7B4	0.9596
107	FK1	0.9596
108	GTQ	0.9594
109	M5K	0.9594
110	4SV	0.9593
111	4HC	0.9592
112	5MI	0.9592
113	7NI	0.9586
114	H4N	0.9585
115	CWS	0.9585
116	11S	0.9584
117	3U4	0.9580
118	25W	0.9580
119	261	0.9580
120	FYU	0.9579
121	0P6	0.9578
122	5WY	0.9570
123	9HX	0.9569
124	AQO	0.9568
125	ISN	0.9568
126	2K4	0.9567
127	10L	0.9564
128	1XM	0.9563
129	KUF	0.9563
130	5B1	0.9561
131	42C	0.9560
132	5M0	0.9559
133	XYP	0.9557
134	0LH	0.9554
135	BOA	0.9552
136	290	0.9550
137	BTE	0.9549
138	5WV	0.9549
139	7WA	0.9546
140	8GC	0.9546
141	UNC	0.9545
142	SRO	0.9544
143	ES6	0.9540
144	NOJ	0.9539
145	AZG	0.9535
146	CFP	0.9535
147	ADZ	0.9533
148	7W4	0.9530
149	XQ0	0.9529
150	8ZE	0.9528
151	5CU	0.9527
152	4CS	0.9527
153	9TZ	0.9526
154	NIZ	0.9525
155	EA1	0.9524
156	FP1	0.9521
157	BHO	0.9520
158	TTY	0.9518
159	2HQ	0.9518
160	YH7	0.9516
161	Q88	0.9510
162	JXN	0.9508
163	54G	0.9505
164	YSO	0.9504
165	32X	0.9504
166	5RO	0.9504
167	6GU	0.9503
168	JZ3	0.9501
169	1DW	0.9498
170	DX4	0.9497
171	7ZE	0.9496
172	G6D	0.9496
173	4ZC	0.9496
174	N2I	0.9496
175	FA0	0.9495
176	8H8	0.9495
177	EQT	0.9494
178	DHQ	0.9491
179	URC	0.9491
180	6CS	0.9490
181	DIE	0.9488
182	ISZ	0.9486
183	5NU	0.9485
184	HMH	0.9485
185	PDC	0.9483
186	TH7	0.9481
187	ABV	0.9481
188	HMU	0.9480
189	8NY	0.9476
190	R8V	0.9472
191	6VD	0.9472
192	LGC	0.9471
193	KDV	0.9471
194	DRL	0.9468
195	JKE	0.9467
196	2BG	0.9467
197	NID	0.9463
198	3F0	0.9463
199	KKN	0.9461
200	M1A	0.9461
201	OW4	0.9458
202	GAL	0.9458
203	XBT	0.9457
204	8CM	0.9456
205	QUZ	0.9455
206	5XC	0.9453
207	4M0	0.9449
208	ET2	0.9448
209	0R0	0.9446
210	ES2	0.9446
211	DOB	0.9445
212	6NT	0.9445
213	QPR	0.9444
214	495	0.9444
215	1P8	0.9444
216	XIY	0.9444
217	3M0	0.9442
218	3AB	0.9442
219	ASO	0.9441
220	3WA	0.9441
221	HH5	0.9441
222	4HM	0.9441
223	G3E	0.9440
224	3MB	0.9439
225	XAZ	0.9439
226	ES7	0.9438
227	FDB	0.9438
228	53C	0.9437
229	4JT	0.9436
230	86J	0.9436
231	LXC	0.9436
232	4XR	0.9436
233	173	0.9433
234	0JD	0.9432
235	3HB	0.9430
236	0HN	0.9430
237	3NY	0.9428
238	0HO	0.9427
239	OVM	0.9426
240	KJU	0.9425
241	2ZQ	0.9422
242	BCP	0.9421
243	GRE	0.9421
244	24B	0.9421
245	N8Y	0.9420
246	VGD	0.9419
247	E7Z	0.9418
248	ALL	0.9417
249	B53	0.9417
250	LCN	0.9416
251	MT0	0.9416
252	A7W	0.9416
253	3Z7	0.9416
254	1F1	0.9416
255	ES0	0.9415
256	BHA	0.9414
257	36R	0.9414
258	2ZM	0.9414
259	INE	0.9412
260	K2T	0.9412
261	FBB	0.9411
262	5JQ	0.9410
263	QWN	0.9410
264	5NI	0.9410
265	AJV	0.9409
266	5HN	0.9409
267	0CU	0.9408
268	KOJ	0.9408
269	BK9	0.9407
270	NK	0.9407
271	3NT	0.9406
272	75K	0.9405
273	3ID	0.9404
274	12Q	0.9403
275	P92	0.9402
276	NPY	0.9401
277	NVU	0.9400
278	HZQ	0.9399
279	5QY	0.9399
280	ODO	0.9398
281	G2F	0.9397
282	5MK	0.9397
283	HQT	0.9397
284	HJP	0.9397
285	3HA	0.9396
286	3Z8	0.9395
287	MUA	0.9394
288	286	0.9393
289	CWM	0.9393
290	IFL	0.9392
291	DBH	0.9392
292	AX7	0.9392
293	SHG	0.9391
294	B55	0.9391
295	UAN	0.9391
296	EUG	0.9391
297	SHA	0.9389
298	BEA	0.9389
299	R8A	0.9386
300	DMD	0.9386
301	IV2	0.9386
302	ZZT	0.9385
303	KT7	0.9384
304	WCE	0.9384
305	KBG	0.9383
306	R8S	0.9383
307	2LP	0.9382
308	JBQ	0.9381
309	CFI	0.9380
310	3DM	0.9379
311	67N	0.9379
312	23A	0.9377
313	3PF	0.9377
314	FOT	0.9376
315	BTY	0.9375
316	270	0.9375
317	GAB	0.9373
318	BDP	0.9373
319	CLW	0.9372
320	PYQ	0.9371
321	FE DB1	0.9368
322	NSP	0.9368
323	DHB	0.9368
324	X09	0.9365
325	6M1	0.9365
326	2HU	0.9365
327	DFB	0.9364
328	JBK	0.9364
329	4TU	0.9364
330	V55	0.9364
331	F0J	0.9363
332	XXR	0.9362
333	B62	0.9361
334	AZ9	0.9360
335	OVV	0.9358
336	8TX	0.9357
337	HQD	0.9356
338	HA5	0.9356
339	IFM	0.9355
340	9R5	0.9355
341	LSA	0.9354
342	4M4	0.9353
343	3SK	0.9352
344	3MA	0.9352
345	PRF	0.9352
346	SX1	0.9351
347	VNJ	0.9351
348	DIN	0.9350
349	BRT	0.9348
350	92P	0.9347
351	CTL	0.9347
352	1WD	0.9345
353	B60	0.9345
354	5VM	0.9345
355	JAW	0.9345
356	15N	0.9345
357	HHA	0.9344
358	7WV	0.9342
359	JUG	0.9340
360	SKA	0.9339
361	7CZ	0.9339
362	MRW	0.9338
363	82I	0.9338
364	GCU	0.9337
365	G5V	0.9336
366	INO	0.9334
367	D48	0.9334
368	39A	0.9333
369	6F0	0.9332
370	PXL	0.9332
371	NNO	0.9332
372	3A9	0.9332
373	PQ0	0.9331
374	8OZ	0.9331
375	C2U	0.9329
376	1M2	0.9329
377	8WT	0.9328
378	5QX	0.9327
379	4JQ	0.9327
380	MQN	0.9326
381	0TU	0.9324
382	2CK	0.9322
383	IJZ	0.9322
384	717	0.9321
385	4ME	0.9320
386	3XX	0.9320
387	LT2	0.9318
388	SYV	0.9318
389	P9P	0.9318
390	MWP	0.9317
391	ABI	0.9317
392	GIO	0.9315
393	4Z4	0.9315
394	JLZ	0.9315
395	9FL	0.9315
396	WOO	0.9314
397	7W1	0.9314
398	PD2	0.9314
399	C2Y	0.9313
400	NQ	0.9311
401	SE2	0.9311
402	B57	0.9310
403	OVP	0.9309
404	MS9	0.9309
405	1PT	0.9309
406	XM0	0.9308
407	12B	0.9306
408	3BZ	0.9304
409	2MI	0.9304
410	VNL	0.9303
411	5JL	0.9303
412	RIB	0.9302
413	ORO	0.9302
414	6NI	0.9300
415	KJY	0.9299
416	J5I	0.9299
417	4NC	0.9298
418	5GU	0.9298
419	OXZ	0.9296
420	QXW	0.9296
421	2CQ	0.9294
422	IAC	0.9294
423	KJH	0.9293
424	2DR	0.9293
425	2ZV	0.9292
426	XHP	0.9292
427	MCT	0.9291
428	G1O	0.9290
429	5JC	0.9290
430	4YO	0.9290
431	NOY	0.9289
432	ADK	0.9288
433	OXC	0.9287
434	MO8	0.9286
435	FHB	0.9286
436	RXA	0.9285
437	DNF	0.9285
438	TTL	0.9285
439	TIU	0.9285
440	J9Q	0.9285
441	GYE	0.9283
442	2H5	0.9283
443	MZG	0.9283
444	CTS	0.9280
445	NDH	0.9280
446	QX4	0.9280
447	EXO	0.9279
448	4A3	0.9279
449	D07	0.9276
450	HX3	0.9276
451	DOR	0.9272
452	0FO	0.9272
453	2D0	0.9269
454	JIF	0.9263
455	DQU	0.9263
456	3R6	0.9262
457	MWJ	0.9262
458	0N7	0.9260
459	LKA	0.9260
460	3IT	0.9259
461	E1T	0.9259
462	MAQ	0.9258
463	MAN	0.9254
464	PHT	0.9252
465	92K	0.9251
466	6LW	0.9250
467	150	0.9250
468	SWA	0.9249
469	ZBT	0.9249
470	FBM	0.9248
471	TSR	0.9247
472	GLT	0.9246
473	CWJ	0.9246
474	DEN	0.9243
475	1WG	0.9243
476	IDM	0.9242
477	4MU	0.9242
478	OTW	0.9242
479	GOJ	0.9240
480	TH0	0.9240
481	UEG	0.9239
482	F9P	0.9238
483	JA8	0.9236
484	4HO	0.9233
485	KIB	0.9233
486	6ME	0.9232
487	93K	0.9231
488	XYL	0.9229
489	RB5	0.9229
490	M6N	0.9229
491	14J	0.9229
492	JB8	0.9229
493	3HM	0.9228
494	MYJ	0.9227
495	4JP	0.9226
496	12M	0.9225
497	PRZ	0.9225
498	4JJ	0.9225
499	HA7	0.9223
500	S76	0.9221
501	CHB	0.9221
502	MBD	0.9220
503	FAN	0.9220
504	ISE	0.9220
505	MWM	0.9218
506	4AA	0.9218
507	4CL	0.9218
508	KYA	0.9218
509	RAM	0.9217
510	XBZ	0.9217
511	94W	0.9217
512	2LY	0.9215
513	9CA	0.9215
514	GVH	0.9214
515	HT4	0.9213
516	0TR	0.9212
517	DBX	0.9211
518	8IG	0.9210
519	EVA	0.9209
520	MVN	0.9209
521	I1E	0.9208
522	IND	0.9208
523	27Y	0.9208
524	BR9	0.9205
525	9TW	0.9205
526	2FY	0.9204
527	4ZE	0.9204
528	URF	0.9203
529	NTM	0.9202
530	2AL	0.9202
531	15L	0.9201
532	JXW	0.9200
533	2MN	0.9199
534	1MC	0.9199
535	TM7	0.9198
536	VK3	0.9198
537	PYG	0.9198
538	FRU	0.9198
539	HBA	0.9198
540	MPI	0.9197
541	APZ	0.9197
542	KBB	0.9196
543	FBV	0.9196
544	DIU	0.9196
545	JZ1	0.9195
546	0CT	0.9195
547	NPO	0.9195
548	BZF	0.9194
549	45C	0.9194
550	OAA	0.9194
551	R9Y	0.9194
552	JZ9	0.9189
553	44W	0.9189
554	GLA	0.9188
555	FH2	0.9188
556	0R1	0.9187
557	OW7	0.9186
558	1GN	0.9185
559	A1U	0.9185
560	GCB	0.9183
561	1P3	0.9183
562	3CE	0.9183
563	5UC	0.9182
564	2YU	0.9181
565	JDN	0.9181
566	CN0	0.9180
567	5NE	0.9180
568	AC0	0.9180
569	149	0.9179
570	DUB	0.9179
571	PA1	0.9178
572	2AC	0.9176
573	PHB	0.9175
574	8WO	0.9175
575	2HO	0.9173
576	5MH	0.9173
577	97T	0.9173
578	EYK	0.9172
579	TPA	0.9172
580	PFB	0.9171
581	8XL	0.9170
582	7MU	0.9170
583	XYS	0.9168
584	TEP	0.9168
585	LDP	0.9168
586	NMJ	0.9167
587	47J	0.9166
588	NCA	0.9166
589	1IT	0.9166
590	6MH	0.9164
591	WBU	0.9164
592	BZI	0.9163
593	QSB	0.9160
594	XLS	0.9159
595	F4Z	0.9159
596	MXN	0.9158
597	DHR	0.9158
598	RNS	0.9157
599	TM4	0.9156
600	44V	0.9156
601	F81	0.9155
602	2CM	0.9155
603	FDK	0.9154
604	SF9	0.9154
605	2AK	0.9154
606	FLM	0.9153
607	FUL	0.9152
608	948	0.9151
609	BEN	0.9151
610	KDF	0.9150
611	TDR	0.9150
612	DGJ	0.9150
613	T6C	0.9150
614	GBD	0.9149
615	SXS	0.9149
616	94B	0.9148
617	TVP	0.9146
618	GXY	0.9146
619	TC7	0.9146
620	F31	0.9146
621	PEA	0.9145
622	LZ1	0.9144
623	329	0.9144
624	FB1	0.9144
625	X6X	0.9143
626	X05	0.9143
627	2FG	0.9142
628	7MH	0.9141
629	FCB	0.9140
630	23J	0.9140
631	PEY	0.9140
632	RMN	0.9139
633	34D	0.9137
634	LYL	0.9137
635	275	0.9137
636	ASC	0.9136
637	HNQ	0.9136
638	R9S	0.9136
639	3OC	0.9135
640	8HC	0.9135
641	NBZ	0.9133
642	TAR	0.9132
643	AW5	0.9132
644	JZ2	0.9132
645	XYD	0.9130
646	P3K	0.9130
647	GMN	0.9129
648	SOE	0.9128
649	091	0.9128
650	SLS	0.9126
651	60P	0.9125
652	6PC	0.9125
653	BMA	0.9124
654	YCP	0.9123
655	OMD	0.9122
656	BEZ	0.9122
657	GOX	0.9121
658	MNM	0.9121
659	2MP	0.9120
660	Z5P	0.9120
661	PAB	0.9120
662	7VJ	0.9119
663	HIS	0.9119
664	J9T	0.9119
665	NDM	0.9118
666	GOO	0.9117
667	CFF	0.9117
668	AEF	0.9117
669	M2H	0.9114
670	2XX	0.9113
671	3MG	0.9113
672	2A7	0.9112
673	2MY	0.9112
674	D1X	0.9111
675	PZA	0.9111
676	0F9	0.9111
677	F12	0.9110
678	3FA	0.9110
679	KYD	0.9110
680	ZYR	0.9110
681	PXM	0.9109
682	IHB	0.9109
683	IPB	0.9107
684	7B3	0.9106
685	8G0	0.9106
686	4P5	0.9106
687	TGX	0.9106
688	DHK	0.9105
689	MZB	0.9104
690	G4D	0.9104
691	SOR	0.9104
692	64K	0.9103
693	HBD	0.9103
694	9FE	0.9103
695	9RW	0.9102
696	4VP	0.9102
697	SJ5	0.9101
698	51R	0.9101
699	AZF	0.9101
700	KLW	0.9100
701	3MC	0.9099
702	BAM	0.9099
703	8XQ	0.9099
704	GIF	0.9097
705	SMN	0.9096
706	OXQ	0.9096
707	IUR	0.9096
708	IP0	0.9095
709	9ZE	0.9095
710	BCU	0.9092
711	43M	0.9092
712	6RQ	0.9088
713	LRH	0.9087
714	1Y6	0.9087
715	DMJ	0.9086
716	34A	0.9086
717	37T	0.9086
718	RM4	0.9083
719	INS	0.9083
720	2KA	0.9083
721	Y8I	0.9083
722	AGK	0.9082
723	PBA	0.9082
724	HY3	0.9082
725	MLT	0.9082
726	DEE	0.9082
727	PKU	0.9082
728	XX2	0.9081
729	NIO	0.9081
730	ZWZ	0.9080
731	H76	0.9080
732	2C9	0.9078
733	TLA	0.9077
734	1U6	0.9077
735	GAF	0.9076
736	GIV	0.9076
737	AFR	0.9075
738	M4E	0.9075
739	YRL	0.9074
740	5AC	0.9072
741	NTZ	0.9072
742	RD4	0.9071
743	3BU	0.9070
744	II6	0.9069
745	MQB	0.9069
746	MFB	0.9067
747	JFD	0.9067
748	H8N	0.9065
749	ZZ3	0.9064
750	3FH	0.9064
751	ICP	0.9063
752	BSX	0.9063
753	MBG	0.9063
754	RIP	0.9063
755	PYD	0.9063
756	8GK	0.9063
757	SS1	0.9063
758	FFP	0.9062
759	3MH	0.9062
760	0FK	0.9062
761	LNR	0.9061
762	15E	0.9061
763	GV9	0.9060
764	GAG	0.9058
765	GDE	0.9058
766	QSC	0.9057
767	ZZ8	0.9057
768	284	0.9057
769	F5B	0.9054
770	CRS	0.9054
771	TOF	0.9053
772	SRT	0.9050
773	GLF	0.9050
774	ARB	0.9050
775	KIA	0.9050
776	GCO	0.9049
777	FBT	0.9048
778	FUC	0.9047
779	BCF	0.9046
780	RCO	0.9044
781	PAF	0.9042
782	ABE	0.9040
783	FPY	0.9039
784	6UA	0.9039
785	0MK	0.9038
786	7WR	0.9038
787	NTN	0.9037
788	FQI	0.9036
789	3RK	0.9035
790	2A9	0.9034
791	YQA	0.9034
792	52C	0.9034
793	OTR	0.9034
794	9KT	0.9033
795	R2B	0.9032
796	LFR	0.9032
797	OA3	0.9032
798	RJY	0.9031
799	4JO	0.9031
800	JG8	0.9031
801	PH2	0.9030
802	KP6	0.9029
803	PBZ	0.9029
804	RSO	0.9028
805	BBF	0.9027
806	APG	0.9027
807	CLZ	0.9027
808	4WL	0.9027
809	MHK	0.9026
810	IOS	0.9024
811	SKM	0.9024
812	174	0.9024
813	FCA	0.9023
814	AIN	0.9022
815	URA	0.9020
816	HIO	0.9018
817	GXL	0.9018
818	YIO	0.9018
819	JXZ	0.9018
820	GCW	0.9017
821	GTR	0.9017
822	PBC	0.9016
823	GOG	0.9015
824	PZI	0.9015
825	N8P	0.9014
826	Z82	0.9014
827	2SX	0.9013
828	APS	0.9012
829	5AN	0.9012
830	X0V	0.9012
831	FPK	0.9011
832	1LN	0.9011
833	O2A	0.9011
834	94N	0.9011
835	DFU	0.9010
836	UNU	0.9010
837	13X	0.9010
838	ZVO	0.9009
839	AC6	0.9009
840	ARP	0.9007
841	BR8	0.9007
842	C2A	0.9006
843	3CH	0.9006
844	AX2	0.9005
845	209	0.9004
846	FHN	0.9003
847	FUF	0.9002
848	RPQ	0.9002
849	HFB	0.9002
850	LG3	0.9001
851	1KP	0.9000
852	1AL	0.8999
853	GTL	0.8999
854	DTL	0.8999
855	4MA	0.8999
856	826	0.8998
857	LG5	0.8997
858	5ZE	0.8996
859	HQJ	0.8996
860	HXX	0.8995
861	CXF	0.8995
862	BDF	0.8994
863	069	0.8993
864	680	0.8993
865	3ZQ	0.8993
866	FBW	0.8993
867	HHR	0.8993
868	ARA	0.8992
869	K5W	0.8992
870	A29	0.8991
871	2ZX	0.8990
872	A13	0.8989
873	26D	0.8989
874	0FN	0.8989
875	XCZ	0.8988
876	GZL	0.8988
877	QAS	0.8986
878	EKZ	0.8986
879	35C	0.8986
880	BVF	0.8985
881	VGL	0.8984
882	TLD	0.8984
883	4KL	0.8984
884	8W9	0.8984
885	DHS	0.8983
886	CYT	0.8981
887	HC4	0.8980
888	NCD	0.8979
889	3AY	0.8978
890	ENL	0.8977
891	IDH	0.8977
892	DPZ	0.8976
893	JFJ	0.8976
894	61M	0.8976
895	DNC	0.8974
896	JTH	0.8974
897	MT5	0.8973
898	1DV	0.8973
899	FUD	0.8971
900	BEW	0.8970
901	IBF	0.8969
902	MFU	0.8968
903	QX2	0.8968
904	260	0.8967
905	IT2	0.8967
906	FBG	0.8966
907	H7Y	0.8966
908	B3R	0.8966
909	H33	0.8965
910	XUL	0.8964
911	PQK	0.8964
912	PCA	0.8963
913	PRY	0.8963
914	AMC	0.8963
915	NGO	0.8962
916	M58	0.8962
917	5WU	0.8962
918	AEH	0.8962
919	ZB1	0.8961
920	IPZ	0.8960
921	4XV	0.8959
922	2F6	0.8959
923	6X8	0.8956
924	JZ4	0.8956
925	PAC	0.8955
926	BZJ	0.8955
927	8GF	0.8953
928	HEW	0.8953
929	40O	0.8953
930	226	0.8952
931	2FQ	0.8952
932	GJS	0.8951
933	M3T	0.8950
934	J1Z	0.8949
935	P72	0.8949
936	HTP	0.8948
937	JU2	0.8947
938	HGQ	0.8946
939	RAT	0.8944
940	DYA	0.8944
941	AL0	0.8942
942	SR1	0.8941
943	GTZ	0.8941
944	PFL	0.8941
945	4H2	0.8939
946	2CH	0.8939
947	IF7	0.8938
948	GT0	0.8937
949	NLA	0.8934
950	4P0	0.8933
951	FLV	0.8933
952	4JM	0.8933
953	GM7	0.8932
954	AJY	0.8932
955	GZ8	0.8932
956	NEQ	0.8932
957	CIG	0.8928
958	4VY	0.8927
959	GIM	0.8927
960	QBK	0.8926
961	MSN	0.8925
962	M5N	0.8923
963	CAQ	0.8923
964	5NS	0.8922
965	UFO	0.8920
966	4FH	0.8919
967	HTS	0.8917
968	QSH	0.8916
969	4XS	0.8915
970	EOL	0.8913
971	6KX	0.8913
972	DQN	0.8913
973	5CL	0.8912
974	42J	0.8912
975	FUB	0.8911
976	Q7A	0.8911
977	TBP	0.8911
978	OXE	0.8910
979	RBL	0.8910
980	95Z	0.8910
981	HLD	0.8910
982	VXX	0.8910
983	FDR	0.8907
984	SVD	0.8906
985	ZXD	0.8904
986	ADA	0.8904
987	GNL	0.8903
988	NSG	0.8903
989	GLY PRO	0.8903
990	ERH	0.8900
991	ONR	0.8900
992	WDL	0.8895
993	Q02	0.8892
994	YTB	0.8891
995	AH8	0.8891
996	938	0.8890
997	MVL	0.8890
998	FBA	0.8890
999	QAT	0.8888
1000	JKZ	0.8886
1001	JZ0	0.8885
1002	QWW	0.8885
1003	HKD	0.8885
1004	MZW	0.8882
1005	30G	0.8882
1006	23W	0.8881
1007	SYN	0.8880
1008	1AN	0.8879
1009	54D	0.8878
1010	1QP	0.8877
1011	DHY	0.8877
1012	2AF	0.8876
1013	2TQ	0.8876
1014	H62	0.8876
1015	92Z	0.8874
1016	I6G	0.8874
1017	T9G	0.8874
1018	URP	0.8874
1019	HHQ	0.8873
1020	A65	0.8871
1021	TFU	0.8869
1022	JND	0.8869
1023	4JL	0.8869
1024	L89	0.8868
1025	RHU	0.8868
1026	QOS	0.8867
1027	OHP	0.8866
1028	PCI	0.8866
1029	I1N	0.8863
1030	282	0.8861
1031	8VN	0.8861
1032	PHU	0.8861
1033	SEJ	0.8860
1034	1XX	0.8859
1035	293	0.8858
1036	1MR	0.8858
1037	AEZ	0.8857
1038	8LG	0.8857
1039	HBX	0.8857
1040	3AL	0.8856
1041	URQ	0.8855
1042	6JN	0.8854
1043	FP2	0.8851
1044	PY7	0.8851
1045	93Q	0.8847
1046	268	0.8847
1047	LI6	0.8847
1048	SMV	0.8847
1049	FPI	0.8847
1050	X8D	0.8846
1051	1DU	0.8846
1052	ICT	0.8844
1053	LDU	0.8843
1054	7ME	0.8843
1055	AMG	0.8842
1056	VOH	0.8841
1057	0GZ	0.8840
1058	76X	0.8839
1059	2PC	0.8838
1060	DA4	0.8838
1061	KFH	0.8835
1062	9PY	0.8835
1063	IFP	0.8834
1064	7D2	0.8833
1065	GJP	0.8831
1066	N7P	0.8830
1067	PYF	0.8830
1068	KTA	0.8830
1069	7N0	0.8829
1070	TZE	0.8826
1071	XRG	0.8826
1072	NGT	0.8825
1073	Q71	0.8825
1074	TBS	0.8824
1075	HSO	0.8823
1076	FGZ	0.8822
1077	K17	0.8821
1078	LMR	0.8821
1079	28N	0.8820
1080	PEL	0.8820
1081	9X7	0.8820
1082	ARW	0.8819
1083	F3B	0.8819
1084	ABN	0.8818
1085	TMZ	0.8816
1086	4A5	0.8814
1087	PYC	0.8814
1088	L99	0.8814
1089	2GS	0.8813
1090	CGB	0.8813
1091	PX7	0.8812
1092	LZ2	0.8811
1093	C9E	0.8810
1094	A09	0.8809
1095	M6W	0.8808
1096	9TY	0.8808
1097	4XX	0.8807
1098	KPL	0.8805
1099	2HC	0.8804
1100	OTD	0.8803
1101	HPY	0.8801
1102	DUC	0.8801
1103	3C2	0.8800
1104	PHH	0.8797
1105	6R8	0.8796
1106	6BL	0.8793
1107	FBU	0.8792
1108	PBE	0.8789
1109	1X7	0.8789
1110	4PW	0.8788
1111	4JU	0.8788
1112	PSV	0.8786
1113	HCI	0.8786
1114	4SX	0.8783
1115	SF6	0.8782
1116	4RU	0.8781
1117	GSY	0.8779
1118	BNS	0.8777
1119	LDR	0.8777
1120	EMZ	0.8776
1121	YAN	0.8775
1122	PRO	0.8772
1123	SYA	0.8772
1124	K34	0.8770
1125	265	0.8769
1126	JZ5	0.8767
1127	GCV	0.8766
1128	2MH	0.8766
1129	67X	0.8765
1130	HQ9	0.8764
1131	7WG	0.8764
1132	NFM	0.8762
1133	ZON	0.8759
1134	EV0	0.8758
1135	ROI	0.8758
1136	CIT	0.8752
1137	BPU	0.8752
1138	FBJ	0.8750
1139	FA1	0.8750
1140	B5D	0.8750
1141	FA3	0.8748
1142	LG4	0.8747
1143	JYB	0.8746
1144	TWO	0.8745
1145	JAB	0.8744
1146	H3M	0.8744
1147	JBN	0.8744
1148	DS0	0.8741
1149	MRZ	0.8741
1150	SR4	0.8740
1151	NBE	0.8739
1152	FOA	0.8739
1153	4AV	0.8738
1154	TCZ	0.8737
1155	YPN	0.8736
1156	39O	0.8736
1157	QY9	0.8734
1158	PCR	0.8733
1159	YHO	0.8732
1160	MMA	0.8731
1161	SFU	0.8731
1162	TMT	0.8730
1163	FB2	0.8730
1164	EJZ	0.8729
1165	M6Z	0.8724
1166	PZM	0.8723
1167	TP5	0.8722
1168	OHG	0.8722
1169	6HQ	0.8721
1170	2CL	0.8721
1171	L5V	0.8720
1172	25R	0.8719
1173	5XB	0.8718
1174	HQE	0.8717
1175	B2J	0.8716
1176	QMS	0.8714
1177	XXP	0.8713
1178	SD4	0.8711
1179	QIC	0.8711
1180	FCR	0.8711
1181	DZX	0.8710
1182	06B	0.8708
1183	PXY	0.8708
1184	DE5	0.8707
1185	258	0.8706
1186	PMB	0.8706
1187	SIF	0.8705
1188	H6B	0.8704
1189	PHE	0.8703
1190	SW7	0.8702
1191	285	0.8699
1192	GJZ	0.8697
1193	GLU	0.8696
1194	UFV	0.8696
1195	TZC	0.8694
1196	ASP	0.8694
1197	F1A	0.8692
1198	FK8	0.8692
1199	ZZZ	0.8691
1200	D3M	0.8690
1201	OK7	0.8690
1202	AUD	0.8690
1203	9KH	0.8689
1204	DA1	0.8684
1205	PLQ	0.8682
1206	K3Q	0.8680
1207	39U	0.8678
1208	9AP	0.8678
1209	HHI	0.8676
1210	AAS	0.8675
1211	2PG	0.8674
1212	XSP	0.8674
1213	C21	0.8673
1214	FLC	0.8673
1215	AS3	0.8671
1216	FPN	0.8671
1217	278	0.8667
1218	7A2	0.8667
1219	ECE	0.8666
1220	NK2	0.8665
1221	DQA	0.8660
1222	MAK	0.8659
1223	280	0.8659
1224	PEZ	0.8659
1225	K22	0.8656
1226	N2Z	0.8656
1227	Q77	0.8650
1228	HHT	0.8650
1229	J01	0.8649
1230	18N	0.8648
1231	SYG	0.8646
1232	PRA	0.8646
1233	0OC	0.8645
1234	HSE	0.8645
1235	463	0.8644
1236	HSM	0.8644
1237	273	0.8642
1238	E3D	0.8641
1239	KGK	0.8639
1240	BNT	0.8638
1241	TEO	0.8634
1242	TAG	0.8633
1243	L7T	0.8632
1244	ASN	0.8625
1245	A7H	0.8624
1246	UY7	0.8621
1247	IUP	0.8617
1248	LT8	0.8616
1249	EDR	0.8616
1250	60Q	0.8615
1251	CIZ	0.8614
1252	CXP	0.8611
1253	KIV	0.8610
1254	CFA	0.8609
1255	HDH	0.8602
1256	FSW	0.8601
1257	RUU	0.8596
1258	3R9	0.8596
1259	9LI	0.8596
1260	3SL	0.8595
1261	7CT	0.8589
1262	XEN	0.8579
1263	DTU	0.8577
1264	3C1	0.8576
1265	GLO	0.8575
1266	K6X	0.8574
1267	M5H	0.8572
1268	3GQ	0.8568
1269	PYJ	0.8566
1270	WOT	0.8560
1271	NXA	0.8548
1272	2HG	0.8547
1273	MNP	0.8546
1274	9YL	0.8537
1275	O7U	0.8531

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

Pocket No.: 1; Query (leader) PDB : 6Y3B; Ligand: O7N; 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: 6y3b.bio1) has 21 residues
No:	Leader PDB	Ligand	Sequence Similarity

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