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Receptor

PDB id	Resolution	Class	Description	Source	Keywords
3NL1	2.15 Å	EC: 1.13.11.4	CRYSTAL STRUCTURE OF SALICYLATE 1,2-DIOXYGENASE FROM PSEUDOA SALICYLATOXIDANS ADDUCTS WITH GENTISATE	PSEUDAMINOBACTER SALICYLATOXIDANS	BETA-SANDWICH OXIDOREDUCTASE
Ref.:	CRYSTAL STRUCTURES OF SALICYLATE 1,2-DIOXYGENASE-SU ADDUCTS: A STEP TOWARDS THE COMPREHENSION OF THE ST BASIS FOR SUBSTRATE SELECTION IN CLASS III RING CLE DIOXYGENASES. J.STRUCT.BIOL. V. 177 431 2012

Ligand

Ligand	Chain:Residue	Validity	Ligand Warnings	Binding Data	Molecular Weight (Da)	Formula	SMILES
FE2	A:369;	Part of Protein;	none;	submit data	55.845	Fe	[Fe+2...
GOL	A:371; A:372;	Invalid; Invalid;	none; none;	submit data	92.094	C3 H8 O3	C(C(C...
GTQ	A:370;	Valid;	none;	submit data	154.12	C7 H6 O4	c1cc(...

View in 3D viewer

90% Homology Family

Leader

PDB id	Resolution	Class	Description	Source	Keywords
3NKT	2.35 Å	EC: 1.13.11.4	CRYSTAL STRUCTURE OF SALICYLATE 1,2-DIOXYGENASE FROM PSEUDOA SALICYLATOXIDANS ADDUCTS WITH NAPHTHOATE	PSEUDAMINOBACTER SALICYLATOXIDANS	BETA-SANDWICH OXIDOREDUCTASE
Ref.:	CRYSTAL STRUCTURES OF SALICYLATE 1,2-DIOXYGENASE-SU ADDUCTS: A STEP TOWARDS THE COMPREHENSION OF THE ST BASIS FOR SUBSTRATE SELECTION IN CLASS III RING CLE DIOXYGENASES. J.STRUCT.BIOL. V. 177 431 2012

Members (4)

No:	PDB id	Binding Data	Representative ligand	Formula	Smiles
The Class containing this family consists of a total of 1 families.
1	3NL1	-	GTQ	C7 H6 O4	c1cc(c(cc1....
2	3NJZ	-	SAL	C7 H6 O3	c1ccc(c(c1....
3	3NKT	-	1HN	C11 H8 O3	c1ccc2c(c1....
4	4FAG	-	GTQ	C7 H6 O4	c1cc(c(cc1....

70% Homology Family (4)

No:	PDB id	Binding Data	Representative ligand	Formula	Smiles
The Class containing this family consists of a total of 1 families.
1	3NL1	-	GTQ	C7 H6 O4	c1cc(c(cc1....
2	3NJZ	-	SAL	C7 H6 O3	c1ccc(c(c1....
3	3NKT	-	1HN	C11 H8 O3	c1ccc2c(c1....
4	4FAG	-	GTQ	C7 H6 O4	c1cc(c(cc1....

50% Homology Family (4)

No:	PDB id	Binding Data	Representative ligand	Formula	Smiles
The Class containing this family consists of a total of 1 families.
1	3NL1	-	GTQ	C7 H6 O4	c1cc(c(cc1....
2	3NJZ	-	SAL	C7 H6 O3	c1ccc(c(c1....
3	3NKT	-	1HN	C11 H8 O3	c1ccc2c(c1....
4	4FAG	-	GTQ	C7 H6 O4	c1cc(c(cc1....

Polypharmacology

Similar Ligands (2D)

Ligand no: 1; Ligand: GTQ; Similar ligands found: 8

No:	Ligand	ECFP6 Tc	MDL keys Tc
1	GTQ	1	1
2	GJS	0.545455	0.863636
3	DOB	0.5	1
4	54G	0.485714	0.909091
5	3R6	0.435897	0.740741
6	BIK	0.428571	0.875
7	SAL	0.411765	0.952381
8	OMD	0.4	0.730769

Similar Ligands (3D)

Ligand no: 1; Ligand: GTQ; Similar ligands found: 1386

No:	Ligand	Similarity coefficient
1	5M0	1.0000
2	6CS	1.0000
3	5RG	1.0000
4	5MK	0.9986
5	9TZ	0.9986
6	SX1	0.9935
7	8S0	0.9824
8	G3F	0.9813
9	BGC	0.9796
10	3NT	0.9794
11	1P7	0.9789
12	GCS	0.9785
13	4CS	0.9781
14	GAB	0.9750
15	8GC	0.9739
16	CWS	0.9737
17	BE2	0.9736
18	3U4	0.9710
19	C2U	0.9705
20	GYE	0.9700
21	3Z8	0.9700
22	3HB	0.9699
23	3OC	0.9698
24	G5V	0.9698
25	5HN	0.9698
26	KUF	0.9697
27	0P6	0.9695
28	ES6	0.9693
29	FOT	0.9692
30	IJZ	0.9691
31	UNC	0.9684
32	E7Z	0.9683
33	JBE	0.9682
34	3AB	0.9677
35	OVV	0.9676
36	AHR	0.9675
37	8CM	0.9675
38	GLC	0.9675
39	JKE	0.9671
40	1DW	0.9671
41	3Z7	0.9669
42	4SV	0.9667
43	53C	0.9665
44	KBB	0.9656
45	3MB	0.9655
46	DBX	0.9655
47	OVM	0.9649
48	EYK	0.9643
49	OW4	0.9642
50	4Z4	0.9640
51	WCE	0.9639
52	HXX	0.9638
53	LGC	0.9637
54	ASC	0.9636
55	5B1	0.9633
56	Q6T	0.9633
57	3BZ	0.9626
58	3DO	0.9624
59	7WV	0.9624
60	HHA	0.9622
61	BRT	0.9620
62	COU	0.9616
63	KT7	0.9612
64	HJP	0.9611
65	7NI	0.9609
66	5RN	0.9608
67	1WD	0.9606
68	RM1	0.9606
69	Q88	0.9605
70	EA1	0.9601
71	H42	0.9600
72	4NC	0.9597
73	7HQ	0.9594
74	2AQ	0.9594
75	I3A	0.9584
76	5OB	0.9584
77	XYP	0.9582
78	SVN	0.9582
79	03V	0.9579
80	VNJ	0.9579
81	4ZC	0.9577
82	JPZ	0.9576
83	JBH	0.9576
84	42C	0.9575
85	9MG	0.9575
86	JB5	0.9572
87	OCH	0.9572
88	IP0	0.9572
89	5Q0	0.9569
90	XX2	0.9568
91	4FS	0.9566
92	1LQ	0.9565
93	N5J	0.9561
94	5NU	0.9559
95	ES1	0.9559
96	ES5	0.9559
97	6M9	0.9558
98	4YS	0.9557
99	ES0	0.9557
100	FE DB1	0.9554
101	MWP	0.9554
102	ICO	0.9553
103	BZX	0.9553
104	7VS	0.9550
105	DBJ	0.9547
106	GAL	0.9546
107	4M4	0.9545
108	EUG	0.9545
109	5SG	0.9544
110	6M4	0.9544
111	3HA	0.9544
112	1SQ	0.9542
113	24W	0.9539
114	5IQ	0.9538
115	V55	0.9534
116	1NP	0.9533
117	M1E	0.9533
118	F05	0.9532
119	2D0	0.9531
120	DBH	0.9531
121	LZM	0.9531
122	NMJ	0.9531
123	3SK	0.9530
124	LT2	0.9528
125	HQY	0.9527
126	DIU	0.9527
127	42A	0.9527
128	86J	0.9526
129	CWM	0.9526
130	MYJ	0.9523
131	G6D	0.9523
132	F0J	0.9521
133	HLZ	0.9519
134	JBK	0.9519
135	25W	0.9519
136	A7W	0.9518
137	P9P	0.9518
138	0RW	0.9515
139	3F0	0.9515
140	1P3	0.9514
141	9EW	0.9513
142	M2K	0.9512
143	BDP	0.9511
144	AKH	0.9509
145	4HM	0.9500
146	L3Q	0.9500
147	5CU	0.9500
148	DHB	0.9499
149	AZA	0.9497
150	5H1	0.9495
151	JAE	0.9494
152	3M0	0.9490
153	M0Q	0.9488
154	M1H	0.9486
155	2HQ	0.9485
156	XAN	0.9485
157	14O	0.9484
158	GUN	0.9484
159	9TW	0.9483
160	VNL	0.9481
161	BZ3	0.9480
162	M1A	0.9480
163	AZ8	0.9479
164	HH8	0.9478
165	ASO	0.9478
166	R8S	0.9475
167	12Q	0.9475
168	9DG	0.9474
169	4JT	0.9473
170	INO	0.9473
171	DIN	0.9473
172	4XH	0.9470
173	PE0	0.9468
174	KBG	0.9466
175	XYL	0.9466
176	NOJ	0.9466
177	F60	0.9465
178	MRW	0.9465
179	5WV	0.9464
180	5QX	0.9464
181	IGA	0.9464
182	NNO	0.9463
183	SOR	0.9461
184	QSB	0.9460
185	5MB	0.9458
186	2HO	0.9456
187	93K	0.9456
188	IV2	0.9455
189	ORO	0.9455
190	R8V	0.9453
191	HPA	0.9451
192	O72	0.9451
193	5XC	0.9451
194	IFL	0.9449
195	FA0	0.9448
196	FHB	0.9447
197	5MI	0.9447
198	LXC	0.9447
199	B60	0.9446
200	KJH	0.9445
201	NOY	0.9443
202	67N	0.9443
203	HQT	0.9443
204	A2F	0.9443
205	QUZ	0.9442
206	MEW	0.9442
207	AQO	0.9441
208	XQG	0.9441
209	6AP	0.9441
210	ADZ	0.9439
211	PDC	0.9439
212	2CK	0.9437
213	APZ	0.9437
214	OVP	0.9436
215	Q24	0.9435
216	ES9	0.9435
217	6AI	0.9434
218	4A3	0.9434
219	EVA	0.9433
220	DNF	0.9432
221	CHB	0.9432
222	G2F	0.9431
223	329	0.9431
224	GCU	0.9431
225	ISN	0.9429
226	SHA	0.9429
227	3HM	0.9429
228	ADE	0.9429
229	LCN	0.9427
230	141	0.9427
231	2K4	0.9426
232	X09	0.9423
233	6LW	0.9422
234	NPY	0.9422
235	1XN	0.9422
236	7HP	0.9421
237	JLZ	0.9421
238	TTL	0.9421
239	1LM	0.9420
240	MAQ	0.9420
241	7W1	0.9418
242	15L	0.9418
243	7ZE	0.9418
244	39A	0.9416
245	J9T	0.9415
246	BTE	0.9414
247	3ID	0.9414
248	4HC	0.9413
249	ES7	0.9412
250	DMD	0.9412
251	M5K	0.9412
252	3XX	0.9411
253	11S	0.9411
254	6MP	0.9410
255	RB5	0.9410
256	FBV	0.9409
257	N8Y	0.9409
258	AZG	0.9408
259	SHG	0.9407
260	9DA	0.9406
261	KJU	0.9405
262	LKA	0.9403
263	7B4	0.9403
264	KKN	0.9400
265	ISD	0.9399
266	J9W	0.9399
267	F31	0.9398
268	GRE	0.9398
269	2AL	0.9397
270	SRO	0.9396
271	6PC	0.9396
272	OXC	0.9395
273	4M0	0.9395
274	1PT	0.9395
275	SVD	0.9393
276	FRU	0.9393
277	173	0.9393
278	0W8	0.9391
279	AJ2	0.9390
280	BHA	0.9389
281	RIB	0.9389
282	9HX	0.9387
283	34D	0.9387
284	H4N	0.9386
285	2ZQ	0.9384
286	2DR	0.9383
287	5WY	0.9383
288	6GU	0.9378
289	10L	0.9377
290	GCW	0.9377
291	7W4	0.9376
292	F5B	0.9376
293	3PF	0.9375
294	DOR	0.9374
295	YH7	0.9373
296	FB1	0.9373
297	G3E	0.9373
298	3WA	0.9373
299	1XM	0.9373
300	XQ0	0.9371
301	GCB	0.9370
302	6M1	0.9370
303	7WA	0.9369
304	IHB	0.9369
305	DX4	0.9366
306	TH7	0.9364
307	BP1	0.9364
308	D1X	0.9364
309	DHQ	0.9362
310	JBQ	0.9362
311	3IT	0.9362
312	PM6	0.9361
313	C2Y	0.9361
314	32X	0.9360
315	TIU	0.9360
316	SKA	0.9360
317	NK	0.9359
318	GIO	0.9356
319	PXL	0.9356
320	FEH	0.9355
321	MO8	0.9355
322	GZL	0.9355
323	495	0.9355
324	SWD	0.9352
325	SWA	0.9352
326	IFM	0.9352
327	ALL	0.9350
328	M1Q	0.9350
329	CFP	0.9350
330	EXO	0.9350
331	C2A	0.9349
332	M6N	0.9348
333	4ME	0.9347
334	GDE	0.9347
335	T9G	0.9347
336	2H5	0.9345
337	DRL	0.9344
338	AW5	0.9344
339	3MA	0.9344
340	92K	0.9343
341	8WT	0.9343
342	R9S	0.9343
343	DHK	0.9342
344	II6	0.9342
345	SJ5	0.9341
346	ADK	0.9340
347	51R	0.9340
348	PD2	0.9338
349	2LY	0.9337
350	290	0.9336
351	BOA	0.9336
352	FP1	0.9335
353	JZ3	0.9335
354	HZQ	0.9334
355	8ZE	0.9333
356	MUA	0.9333
357	YCP	0.9333
358	SXS	0.9331
359	069	0.9331
360	NCA	0.9331
361	2ZV	0.9330
362	2EC	0.9329
363	MR1	0.9329
364	SE2	0.9327
365	KOJ	0.9327
366	BEZ	0.9327
367	6F0	0.9326
368	5QY	0.9326
369	261	0.9324
370	NCD	0.9324
371	MT0	0.9323
372	CTS	0.9323
373	SYV	0.9323
374	5GU	0.9323
375	FK1	0.9323
376	NDM	0.9322
377	XXR	0.9319
378	0F9	0.9318
379	XCZ	0.9317
380	BAM	0.9316
381	WOO	0.9315
382	ES4	0.9312
383	LSA	0.9311
384	MXN	0.9310
385	IPB	0.9310
386	23A	0.9309
387	4MU	0.9309
388	R8A	0.9309
389	AZ9	0.9309
390	D48	0.9307
391	UAN	0.9307
392	GLT	0.9306
393	DFB	0.9306
394	BEA	0.9304
395	NDH	0.9303
396	RSF	0.9303
397	SRT	0.9302
398	HLR	0.9302
399	KYD	0.9301
400	OAA	0.9301
401	QPR	0.9300
402	FBW	0.9300
403	PZA	0.9300
404	CN0	0.9299
405	VGD	0.9299
406	BEN	0.9298
407	TAR	0.9296
408	OW7	0.9295
409	5WX	0.9295
410	92P	0.9294
411	FUL	0.9293
412	XLS	0.9292
413	JA8	0.9292
414	FYU	0.9292
415	FBB	0.9291
416	ABV	0.9291
417	4AA	0.9289
418	SYG	0.9288
419	7MU	0.9287
420	286	0.9287
421	KJY	0.9286
422	3NY	0.9285
423	NID	0.9285
424	YQA	0.9284
425	NIO	0.9283
426	URC	0.9283
427	2XX	0.9282
428	HIO	0.9282
429	NBZ	0.9282
430	60P	0.9281
431	2MN	0.9280
432	ES2	0.9279
433	F12	0.9279
434	2ZM	0.9278
435	1WG	0.9277
436	0R0	0.9277
437	0CU	0.9277
438	QWN	0.9275
439	5RO	0.9275
440	DEN	0.9274
441	8NY	0.9274
442	J5I	0.9272
443	ET2	0.9270
444	HT4	0.9270
445	8EZ	0.9268
446	MWM	0.9268
447	NIZ	0.9268
448	N2I	0.9265
449	1P8	0.9265
450	AL0	0.9264
451	Z5P	0.9264
452	1AL	0.9262
453	BSX	0.9261
454	GIF	0.9260
455	SKM	0.9260
456	36R	0.9259
457	RNT	0.9256
458	HQ9	0.9256
459	IPZ	0.9256
460	XM0	0.9255
461	QSC	0.9254
462	82I	0.9254
463	S76	0.9254
464	X05	0.9253
465	INE	0.9251
466	TLA	0.9250
467	DPZ	0.9247
468	HH5	0.9246
469	2CQ	0.9246
470	XYS	0.9246
471	2LP	0.9245
472	URF	0.9245
473	MLT	0.9245
474	2AK	0.9243
475	4XR	0.9243
476	F9P	0.9240
477	37T	0.9239
478	PZI	0.9239
479	RXA	0.9238
480	GAG	0.9238
481	0JD	0.9237
482	JZ1	0.9237
483	FDB	0.9236
484	PYQ	0.9236
485	M2H	0.9236
486	HQD	0.9236
487	PHT	0.9236
488	0N7	0.9235
489	CLW	0.9235
490	BHO	0.9235
491	GLA	0.9235
492	LMR	0.9234
493	GM7	0.9233
494	ISZ	0.9233
495	EKZ	0.9232
496	TM7	0.9230
497	RNS	0.9229
498	BCU	0.9228
499	CTL	0.9228
500	AJV	0.9228
501	G1O	0.9228
502	8G0	0.9228
503	BMA	0.9228
504	0HO	0.9228
505	SS1	0.9228
506	DIE	0.9228
507	RAT	0.9227
508	PRZ	0.9226
509	O7U	0.9226
510	150	0.9225
511	6NT	0.9225
512	NFQ	0.9225
513	QAT	0.9225
514	43M	0.9225
515	K2T	0.9224
516	1LN	0.9224
517	NQ	0.9224
518	3MG	0.9224
519	7N0	0.9224
520	CFI	0.9223
521	ZXD	0.9223
522	0HN	0.9223
523	5JC	0.9222
524	ONR	0.9222
525	UNU	0.9222
526	VGL	0.9221
527	IDM	0.9221
528	45L	0.9221
529	4ZE	0.9221
530	2YU	0.9219
531	NTM	0.9218
532	3FH	0.9218
533	H76	0.9217
534	4NG	0.9216
535	QXW	0.9215
536	GBD	0.9214
537	J9Q	0.9214
538	LDP	0.9213
539	PBC	0.9213
540	EQT	0.9213
541	0LH	0.9213
542	24B	0.9213
543	HMU	0.9212
544	2A7	0.9211
545	QSH	0.9211
546	XBZ	0.9210
547	TOF	0.9210
548	JUG	0.9209
549	BE7	0.9207
550	VK3	0.9206
551	IFP	0.9205
552	TSS	0.9205
553	97T	0.9205
554	L99	0.9205
555	JND	0.9204
556	2PG	0.9203
557	LNR	0.9203
558	XSP	0.9203
559	AGK	0.9203
560	MCT	0.9202
561	OXZ	0.9201
562	MZG	0.9201
563	091	0.9200
564	BTY	0.9198
565	G4D	0.9198
566	XX3	0.9198
567	2HU	0.9198
568	K5W	0.9197
569	B55	0.9196
570	FH2	0.9195
571	O2A	0.9194
572	XAZ	0.9193
573	WBU	0.9193
574	X0V	0.9190
575	34A	0.9189
576	HMH	0.9189
577	5AC	0.9189
578	7ME	0.9188
579	HX3	0.9188
580	BK9	0.9187
581	MZB	0.9187
582	8TX	0.9187
583	GTR	0.9187
584	2AC	0.9186
585	AZF	0.9186
586	DGJ	0.9186
587	12M	0.9186
588	ISE	0.9186
589	NTN	0.9185
590	XYD	0.9184
591	GZ8	0.9184
592	A1U	0.9184
593	GOX	0.9183
594	FDK	0.9182
595	X6X	0.9182
596	AX7	0.9182
597	BR9	0.9181
598	275	0.9180
599	1GN	0.9180
600	2MP	0.9179
601	QOS	0.9178
602	ABI	0.9178
603	BZI	0.9178
604	FBM	0.9177
605	IND	0.9177
606	BZF	0.9176
607	5VM	0.9175
608	MNN	0.9175
609	QBK	0.9175
610	7VJ	0.9175
611	NTZ	0.9175
612	IF7	0.9174
613	8OZ	0.9173
614	23J	0.9173
615	4HO	0.9171
616	RMN	0.9171
617	1DJ	0.9169
618	3A9	0.9168
619	DYA	0.9167
620	2MI	0.9166
621	4CL	0.9166
622	GIV	0.9166
623	TTY	0.9165
624	75K	0.9164
625	DIG	0.9164
626	ZWZ	0.9164
627	4FH	0.9164
628	B53	0.9164
629	270	0.9163
630	JFJ	0.9163
631	MWJ	0.9163
632	LFR	0.9162
633	1F1	0.9162
634	B62	0.9162
635	4JJ	0.9161
636	4TU	0.9160
637	TDR	0.9159
638	F9Y	0.9158
639	FGZ	0.9157
640	MS9	0.9156
641	PXM	0.9154
642	VOH	0.9154
643	4SX	0.9154
644	ROR	0.9153
645	JZ9	0.9152
646	RAM	0.9151
647	2RH	0.9150
648	A13	0.9148
649	AC0	0.9147
650	OXQ	0.9147
651	GV9	0.9145
652	9FL	0.9145
653	UFO	0.9145
654	XIY	0.9145
655	ZZT	0.9144
656	5UC	0.9144
657	AFR	0.9143
658	4YO	0.9143
659	5JQ	0.9143
660	6NI	0.9143
661	DQU	0.9143
662	45C	0.9142
663	INS	0.9142
664	PA1	0.9142
665	DMJ	0.9142
666	3AL	0.9142
667	TH0	0.9141
668	JZ4	0.9140
669	LZ1	0.9140
670	NPO	0.9140
671	A29	0.9139
672	KLW	0.9138
673	PRY	0.9138
674	2FY	0.9137
675	6ME	0.9136
676	BCP	0.9136
677	OHP	0.9136
678	9PY	0.9136
679	QX2	0.9135
680	27Y	0.9135
681	SF9	0.9134
682	3DM	0.9133
683	2FG	0.9133
684	M58	0.9132
685	ODO	0.9132
686	SOE	0.9131
687	1MC	0.9130
688	9RW	0.9130
689	FBT	0.9130
690	TEP	0.9130
691	5NI	0.9130
692	6VD	0.9129
693	QAS	0.9129
694	4JP	0.9129
695	URQ	0.9129
696	PFB	0.9126
697	PYD	0.9125
698	ICP	0.9125
699	MAN	0.9125
700	TRA	0.9125
701	HY3	0.9125
702	AH8	0.9124
703	KDV	0.9123
704	0TU	0.9123
705	M4E	0.9123
706	149	0.9122
707	UEG	0.9122
708	0R1	0.9121
709	TLD	0.9121
710	MPI	0.9120
711	LRH	0.9119
712	FCA	0.9119
713	MNM	0.9118
714	GVH	0.9118
715	IPM	0.9116
716	BNS	0.9116
717	12B	0.9116
718	TSR	0.9115
719	5MH	0.9114
720	7WR	0.9114
721	DHS	0.9114
722	JZ2	0.9113
723	FX1	0.9113
724	TEO	0.9113
725	YIO	0.9112
726	39O	0.9112
727	14J	0.9112
728	RSO	0.9112
729	NVU	0.9111
730	PAF	0.9111
731	0CT	0.9111
732	F4Z	0.9110
733	B57	0.9110
734	QDK	0.9109
735	QWW	0.9108
736	MQN	0.9108
737	4JQ	0.9108
738	0FO	0.9108
739	94B	0.9107
740	8IG	0.9107
741	4P0	0.9107
742	M0W	0.9107
743	PHB	0.9107
744	OA3	0.9106
745	3RK	0.9106
746	Y8I	0.9106
747	OTW	0.9105
748	284	0.9105
749	DNC	0.9103
750	XHP	0.9102
751	9R5	0.9101
752	PAB	0.9101
753	I1E	0.9100
754	2BG	0.9100
755	ZZ3	0.9100
756	5CL	0.9100
757	ARB	0.9100
758	SMN	0.9098
759	GOG	0.9097
760	PCA	0.9096
761	GLF	0.9096
762	JAW	0.9096
763	PEY	0.9094
764	JIF	0.9094
765	TC7	0.9093
766	717	0.9093
767	XUL	0.9093
768	T6C	0.9093
769	GRO	0.9092
770	1U6	0.9091
771	RJY	0.9090
772	948	0.9090
773	HA5	0.9090
774	R9Y	0.9090
775	YSO	0.9089
776	MBG	0.9088
777	7CZ	0.9088
778	HNQ	0.9086
779	PBA	0.9085
780	SS2	0.9085
781	D07	0.9084
782	5JL	0.9083
783	8W9	0.9083
784	44V	0.9079
785	HIS	0.9078
786	HA7	0.9077
787	RCO	0.9077
788	3CH	0.9077
789	Z82	0.9077
790	JXN	0.9076
791	H7Y	0.9076
792	HQJ	0.9076
793	ADA	0.9073
794	4JO	0.9073
795	293	0.9072
796	GOO	0.9072
797	HY1	0.9071
798	P92	0.9070
799	0MK	0.9070
800	N2Z	0.9070
801	2TQ	0.9069
802	52C	0.9069
803	94W	0.9068
804	GT0	0.9068
805	7MH	0.9067
806	P3K	0.9067
807	8XQ	0.9067
808	FPK	0.9066
809	PHU	0.9064
810	COI	0.9064
811	MFB	0.9064
812	FLV	0.9063
813	CFF	0.9062
814	EOL	0.9061
815	MSN	0.9061
816	URA	0.9060
817	IT2	0.9059
818	AC6	0.9059
819	44W	0.9059
820	226	0.9059
821	SR1	0.9059
822	CRS	0.9059
823	4XV	0.9058
824	ASP	0.9058
825	LYL	0.9057
826	NGO	0.9057
827	DA4	0.9055
828	CLZ	0.9054
829	CWJ	0.9054
830	F81	0.9053
831	4RW	0.9052
832	IUR	0.9052
833	BDF	0.9047
834	TZE	0.9045
835	FAN	0.9042
836	CIT	0.9042
837	9KH	0.9042
838	FUC	0.9041
839	GAF	0.9039
840	54D	0.9038
841	IDH	0.9037
842	XBT	0.9037
843	KFH	0.9037
844	9CA	0.9036
845	4XS	0.9036
846	LG3	0.9035
847	0TR	0.9032
848	3CU	0.9031
849	NGT	0.9031
850	HBD	0.9030
851	28N	0.9029
852	CYT	0.9029
853	3YP	0.9028
854	RPQ	0.9028
855	AEH	0.9027
856	GOJ	0.9026
857	ZB1	0.9023
858	MVN	0.9023
859	35C	0.9022
860	AN0	0.9022
861	LG5	0.9022
862	DTL	0.9021
863	RD4	0.9021
864	MHK	0.9018
865	EDR	0.9017
866	47J	0.9017
867	DFU	0.9016
868	JB8	0.9016
869	6RQ	0.9014
870	1IT	0.9013
871	MT5	0.9013
872	KTA	0.9012
873	26D	0.9012
874	RIP	0.9011
875	GXL	0.9011
876	NSP	0.9011
877	PEZ	0.9010
878	QIC	0.9010
879	BVF	0.9010
880	VXX	0.9009
881	4AV	0.9008
882	7WG	0.9008
883	463	0.9007
884	6JN	0.9007
885	TPA	0.9005
886	95Z	0.9003
887	209	0.9003
888	PFL	0.9003
889	HLD	0.9002
890	8GK	0.9002
891	PRF	0.9001
892	8H8	0.9001
893	GTZ	0.9000
894	AMC	0.8999
895	0FK	0.8999
896	M4T	0.8999
897	6R8	0.8999
898	JDN	0.8998
899	I1N	0.8996
900	9FE	0.8996
901	SD4	0.8994
902	FBU	0.8994
903	15N	0.8993
904	ZZ8	0.8993
905	RM4	0.8992
906	AUD	0.8991
907	QX4	0.8990
908	64K	0.8989
909	JFD	0.8987
910	1Y6	0.8987
911	D3M	0.8986
912	PAC	0.8983
913	ICT	0.8983
914	SYA	0.8982
915	FA1	0.8982
916	3BU	0.8982
917	M6Z	0.8981
918	ABE	0.8980
919	GXY	0.8980
920	JTH	0.8980
921	EV0	0.8977
922	TAG	0.8977
923	SAF	0.8976
924	H62	0.8976
925	CBF	0.8976
926	MJ2	0.8975
927	4P5	0.8974
928	SC2	0.8973
929	0GZ	0.8972
930	PQ0	0.8971
931	I2M	0.8971
932	SF6	0.8971
933	EDG	0.8969
934	N8P	0.8969
935	PYG	0.8969
936	PHH	0.8967
937	FQI	0.8967
938	DQA	0.8967
939	MBD	0.8967
940	FPY	0.8966
941	FHN	0.8966
942	FUD	0.8964
943	1M2	0.8963
944	Q02	0.8963
945	5XB	0.8962
946	AIN	0.8962
947	HKD	0.8961
948	PMB	0.8961
949	PBZ	0.8960
950	B2J	0.8960
951	FBG	0.8958
952	FCB	0.8957
953	SW7	0.8957
954	EJZ	0.8957
955	FUB	0.8956
956	826	0.8956
957	HFB	0.8954
958	HBA	0.8954
959	P72	0.8951
960	5NE	0.8951
961	ICF	0.8950
962	JKZ	0.8950
963	KIB	0.8950
964	PKU	0.8949
965	HTP	0.8948
966	ARA	0.8947
967	TFU	0.8947
968	MVL	0.8947
969	8WO	0.8947
970	AY4	0.8946
971	CDV	0.8946
972	4MA	0.8945
973	Q7A	0.8945
974	TGX	0.8944
975	H33	0.8943
976	8GF	0.8943
977	7B3	0.8941
978	1AB	0.8941
979	GIM	0.8941
980	AS3	0.8940
981	AHB	0.8939
982	PEP	0.8939
983	2FQ	0.8938
984	KP6	0.8936
985	TWO	0.8936
986	OTD	0.8936
987	AOS	0.8935
988	42J	0.8935
989	DEE	0.8934
990	PEQ	0.8934
991	RBL	0.8934
992	L5V	0.8934
993	FA3	0.8934
994	CIG	0.8933
995	8HC	0.8932
996	GCO	0.8932
997	9KT	0.8932
998	4H2	0.8932
999	3SL	0.8931
1000	51F	0.8931
1001	N7P	0.8930
1002	MB1	0.8929
1003	KYA	0.8928
1004	GNL	0.8927
1005	SIF	0.8926
1006	NEQ	0.8926
1007	ZBT	0.8924
1008	60Q	0.8924
1009	F69	0.8924
1010	8EW	0.8922
1011	DQN	0.8922
1012	0FN	0.8921
1013	6OT	0.8920
1014	7MX	0.8919
1015	2A9	0.8918
1016	B3R	0.8917
1017	BNT	0.8917
1018	174	0.8915
1019	GLY PRO	0.8915
1020	AJY	0.8914
1021	MRZ	0.8914
1022	KPL	0.8914
1023	FUF	0.8914
1024	HEW	0.8914
1025	MFU	0.8913
1026	BCF	0.8910
1027	M3T	0.8909
1028	BR8	0.8908
1029	APG	0.8907
1030	HGQ	0.8907
1031	JYB	0.8906
1032	PH2	0.8904
1033	UFV	0.8903
1034	61M	0.8902
1035	XRG	0.8901
1036	23W	0.8901
1037	CXF	0.8900
1038	6BL	0.8899
1039	3HP	0.8899
1040	6UA	0.8899
1041	1DV	0.8899
1042	I6G	0.8898
1043	TRC	0.8898
1044	13X	0.8898
1045	8XL	0.8897
1046	7D2	0.8894
1047	X8D	0.8894
1048	OK7	0.8893
1049	3FA	0.8893
1050	15E	0.8890
1051	HHR	0.8890
1052	ZVO	0.8888
1053	E1T	0.8888
1054	XXG	0.8888
1055	AEZ	0.8887
1056	1XX	0.8885
1057	CRN	0.8885
1058	1KP	0.8882
1059	LI6	0.8882
1060	FB2	0.8882
1061	URP	0.8880
1062	2F6	0.8879
1063	QY9	0.8879
1064	ABN	0.8879
1065	3ZQ	0.8878
1066	KDF	0.8878
1067	BSP	0.8877
1068	30G	0.8877
1069	PBE	0.8876
1070	8VN	0.8875
1071	AX2	0.8875
1072	MMA	0.8874
1073	2MY	0.8874
1074	2ZX	0.8873
1075	ASN	0.8873
1076	GMN	0.8873
1077	HDH	0.8872
1078	40E	0.8872
1079	B5D	0.8871
1080	IAC	0.8870
1081	DHR	0.8869
1082	4VY	0.8869
1083	BBF	0.8869
1084	LDR	0.8869
1085	6TZ	0.8869
1086	GTL	0.8867
1087	RHU	0.8867
1088	SYN	0.8866
1089	2CM	0.8866
1090	HSE	0.8865
1091	FLM	0.8865
1092	5AN	0.8865
1093	9ZE	0.8864
1094	ZYR	0.8864
1095	PSV	0.8864
1096	263	0.8863
1097	TBP	0.8863
1098	GCV	0.8861
1099	3CE	0.8861
1100	GJZ	0.8860
1101	6MH	0.8860
1102	1X7	0.8858
1103	2C9	0.8858
1104	HHQ	0.8856
1105	HBX	0.8855
1106	PCI	0.8853
1107	DUB	0.8852
1108	4VP	0.8851
1109	ENL	0.8851
1110	KIA	0.8851
1111	GLO	0.8850
1112	R20	0.8850
1113	IBF	0.8850
1114	EMZ	0.8848
1115	YTB	0.8848
1116	282	0.8847
1117	3AY	0.8846
1118	SNE	0.8844
1119	1U1	0.8844
1120	9AP	0.8844
1121	1MR	0.8843
1122	3MC	0.8843
1123	5ZE	0.8843
1124	DII	0.8842
1125	Q71	0.8841
1126	PQK	0.8841
1127	AMG	0.8837
1128	4FA	0.8836
1129	9TY	0.8833
1130	JF2	0.8833
1131	ARP	0.8832
1132	K17	0.8832
1133	PY7	0.8832
1134	BZJ	0.8831
1135	OTR	0.8830
1136	CIZ	0.8828
1137	FPI	0.8827
1138	M5N	0.8826
1139	IOS	0.8825
1140	TBS	0.8823
1141	J1Z	0.8822
1142	PX7	0.8822
1143	1QP	0.8821
1144	ESI	0.8820
1145	PYF	0.8820
1146	680	0.8820
1147	LT8	0.8818
1148	DUC	0.8818
1149	5WU	0.8815
1150	NK2	0.8815
1151	NCT	0.8814
1152	39U	0.8813
1153	C21	0.8811
1154	2CL	0.8810
1155	SLS	0.8808
1156	ERH	0.8808
1157	4SD	0.8808
1158	APY	0.8805
1159	FLC	0.8804
1160	H6B	0.8804
1161	4WL	0.8804
1162	C9E	0.8802
1163	MZW	0.8802
1164	06B	0.8801
1165	40O	0.8800
1166	3C2	0.8800
1167	PRO	0.8799
1168	L7T	0.8799
1169	K22	0.8799
1170	2AS	0.8798
1171	NBE	0.8798
1172	5DI	0.8796
1173	20J	0.8796
1174	APS	0.8793
1175	XXP	0.8793
1176	BEW	0.8792
1177	F3B	0.8790
1178	2GS	0.8790
1179	KGK	0.8790
1180	P84	0.8790
1181	4ZA	0.8789
1182	A65	0.8788
1183	2PC	0.8787
1184	M3H	0.8786
1185	FFP	0.8785
1186	LEU	0.8785
1187	4A5	0.8784
1188	WDL	0.8783
1189	CKU	0.8783
1190	0XT	0.8783
1191	260	0.8783
1192	AEF	0.8782
1193	CAQ	0.8782
1194	5VL	0.8781
1195	AKG	0.8781
1196	DHY	0.8780
1197	OXE	0.8780
1198	QUS	0.8778
1199	K34	0.8777
1200	JZ5	0.8776
1201	JXZ	0.8775
1202	9CL	0.8775
1203	BPU	0.8774
1204	JXW	0.8772
1205	0OC	0.8771
1206	2SX	0.8769
1207	FCR	0.8768
1208	DZX	0.8767
1209	JYD	0.8766
1210	ITN	0.8766
1211	TP5	0.8765
1212	MAJ	0.8765
1213	SDD	0.8764
1214	3MH	0.8764
1215	AHN	0.8764
1216	GVG	0.8764
1217	HPY	0.8762
1218	2CH	0.8762
1219	H3M	0.8761
1220	SAN	0.8761
1221	FDR	0.8760
1222	JG8	0.8760
1223	FBA	0.8759
1224	1A7	0.8759
1225	PHE	0.8757
1226	MAK	0.8757
1227	E5X	0.8757
1228	13P	0.8757
1229	271	0.8757
1230	GZ3	0.8755
1231	265	0.8754
1232	IOM	0.8754
1233	6HQ	0.8754
1234	KIV	0.8754
1235	TT4	0.8750
1236	4JM	0.8749
1237	QM1	0.8748
1238	4VS	0.8747
1239	9X7	0.8746
1240	UY7	0.8745
1241	1DU	0.8744
1242	SOL	0.8742
1243	3R9	0.8742
1244	2AF	0.8742
1245	SMV	0.8740
1246	280	0.8738
1247	EN1	0.8735
1248	GLU	0.8734
1249	57O	0.8734
1250	GZQ	0.8734
1251	MLE	0.8730
1252	WOT	0.8730
1253	B24	0.8730
1254	JZ0	0.8729
1255	R67	0.8728
1256	HTS	0.8727
1257	PEA	0.8726
1258	4KL	0.8726
1259	92Z	0.8726
1260	6X8	0.8725
1261	94N	0.8725
1262	J6W	0.8724
1263	KTW	0.8723
1264	JBN	0.8723
1265	PYC	0.8722
1266	K6X	0.8720
1267	FIX	0.8720
1268	938	0.8719
1269	FK8	0.8718
1270	F1A	0.8718
1271	TSU	0.8718
1272	8LG	0.8716
1273	1AN	0.8714
1274	PYJ	0.8714
1275	5NS	0.8711
1276	AAS	0.8710
1277	PEL	0.8710
1278	67X	0.8709
1279	MQB	0.8708
1280	FSW	0.8708
1281	152	0.8707
1282	PNZ	0.8707
1283	FOA	0.8706
1284	7I2	0.8706
1285	93Q	0.8705
1286	PJW	0.8704
1287	0W1	0.8704
1288	285	0.8702
1289	7A3	0.8701
1290	W81	0.8697
1291	AX3	0.8697
1292	G12	0.8696
1293	CH9	0.8693
1294	PIM	0.8692
1295	URS	0.8692
1296	FP2	0.8692
1297	BZ2	0.8692
1298	YHO	0.8691
1299	PIY	0.8691
1300	J9N	0.8691
1301	SPV	0.8688
1302	2KA	0.8688
1303	ESP	0.8688
1304	4PW	0.8687
1305	NXA	0.8684
1306	ORN	0.8683
1307	3C1	0.8683
1308	L89	0.8683
1309	E35	0.8680
1310	LPK	0.8679
1311	IHG	0.8672
1312	DX3	0.8671
1313	TZC	0.8671
1314	TCZ	0.8671
1315	2O6	0.8668
1316	GF4	0.8668
1317	ROI	0.8666
1318	JF1	0.8665
1319	TYL	0.8663
1320	XDE	0.8661
1321	6XI	0.8661
1322	CGB	0.8658
1323	LZ2	0.8658
1324	JU2	0.8658
1325	YRL	0.8657
1326	B0D	0.8656
1327	7CT	0.8652
1328	OHG	0.8652
1329	4JU	0.8652
1330	76X	0.8650
1331	SEJ	0.8650
1332	V1T	0.8650
1333	NLA	0.8649
1334	1HN	0.8648
1335	278	0.8648
1336	FBS	0.8647
1337	4JL	0.8646
1338	ARW	0.8644
1339	K32	0.8643
1340	YAN	0.8641
1341	DAS	0.8640
1342	FLA	0.8639
1343	273	0.8638
1344	XEN	0.8635
1345	Q77	0.8635
1346	4RU	0.8633
1347	GJP	0.8632
1348	NHG	0.8630
1349	1WC	0.8630
1350	K2P	0.8625
1351	HHT	0.8625
1352	HC4	0.8625
1353	GLY CYS	0.8625
1354	JAB	0.8621
1355	2MH	0.8619
1356	TM4	0.8616
1357	C2B	0.8616
1358	6KT	0.8615
1359	E3D	0.8614
1360	MAE	0.8609
1361	ANN	0.8608
1362	4J8	0.8605
1363	ECE	0.8601
1364	K8X	0.8601
1365	JR2	0.8601
1366	SFU	0.8600
1367	E7S	0.8591
1368	NBG	0.8588
1369	49O	0.8586
1370	FA6	0.8584
1371	PLQ	0.8584
1372	OGA	0.8581
1373	2K8	0.8575
1374	7UC	0.8574
1375	3TJ	0.8568
1376	ESX	0.8566
1377	3C4	0.8561
1378	A09	0.8558
1379	259	0.8556
1380	8K2	0.8549
1381	X0W	0.8546
1382	18N	0.8546
1383	HQE	0.8543
1384	REL	0.8537
1385	FXH	0.8527
1386	EGR	0.8517

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

Pocket No.: 1; Query (leader) PDB : 3NKT; Ligand: 1HN; 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: 3nkt.bio1) has 14 residues
No:	Leader PDB	Ligand	Sequence Similarity

Pocket No.: 2; Query (leader) PDB : 3NKT; Ligand: 1HN; 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: 3nkt.bio1) has 14 residues
No:	Leader PDB	Ligand	Sequence Similarity

Pocket No.: 3; Query (leader) PDB : 3NKT; Ligand: 1HN; 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: 3nkt.bio1) has 14 residues
No:	Leader PDB	Ligand	Sequence Similarity

Pocket No.: 4; Query (leader) PDB : 3NKT; Ligand: 1HN; 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: 3nkt.bio1) has 14 residues
No:	Leader PDB	Ligand	Sequence Similarity

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