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Receptor

PDB id	Resolution	Class	Description	Source	Keywords
3PPR	2.1 Å	NON-ENZYME: BINDING	STRUCTURES OF THE SUBSTRATE-BINDING PROTEIN PROVIDE INSIGHTS MULTIPLE COMPATIBLE SOLUTES BINDING SPECIFICITIES OF BACILLS UBTILIS ABC TRANSPORTER OPUC	BACILLUS SUBTILIS	ALPHA-BETA-ALPHA SANDWICH OSMOPROTECTANT TRANSPORT PROTEIN
Ref.:	STRUCTURES OF THE SUBSTRATE-BINDING PROTEIN PROVIDE INTO THE MULTIPLE COMPATIBLE SOLUTE BINDING SPECIFI THE BACILLUS SUBTILIS ABC TRANSPORTER OPUC BIOCHEM.J. V. 436 283 2011

Ligand

Ligand	Chain:Residue	Validity	Ligand Warnings	Binding Data	NGL Viewer	Molecular Weight (Da)	Formula	SMILES
4CS	A:401; B:401;	Valid; Valid;	none; none;	Kd = 1.5 mM		142.156	C6 H10 N2 O2	CC1=N...

View in 3D viewer

90% Homology Family

Leader

PDB id	Resolution	Class	Description	Source	Keywords
3PPQ	1.91 Å	NON-ENZYME: BINDING	STRUCTURES OF THE SUBSTRATE-BINDING PROTEIN PROVIDE INSIGHTS MULTIPLE COMPATIBLE SOLUTES BINDING SPECIFICITIES OF BACILLS UBTILIS ABC TRANSPORTER OPUC	BACILLUS SUBTILIS	ALPHA-BETA-ALPHA SANDWICH OSMOPROTECTANT TRANSPORT PROTEIN
Ref.:	STRUCTURES OF THE SUBSTRATE-BINDING PROTEIN PROVIDE INTO THE MULTIPLE COMPATIBLE SOLUTE BINDING SPECIFI THE BACILLUS SUBTILIS ABC TRANSPORTER OPUC BIOCHEM.J. V. 436 283 2011

Members (2)

No:	PDB id	Binding Data	Representative ligand	Formula	Smiles
The Class containing this family consists of a total of 552 families.
1	3PPR	Kd = 1.5 mM	4CS	C6 H10 N2 O2	CC1=N[C@@H....
2	3PPQ	Kd = 28 uM	CHT	C5 H14 N O	C[N+](C)(C....

70% Homology Family (4)

No:	PDB id	Binding Data	Representative ligand	Formula	Smiles
The Class containing this family consists of a total of 426 families.
1	3PPR	Kd = 1.5 mM	4CS	C6 H10 N2 O2	CC1=N[C@@H....
2	3PPQ	Kd = 28 uM	CHT	C5 H14 N O	C[N+](C)(C....
3	5NXY	-	1Y8	C5 H14 As O	C[As](C)(C....
4	3R6U	Kd = 30.5 uM	CHT	C5 H14 N O	C[N+](C)(C....

50% Homology Family (4)

No:	PDB id	Binding Data	Representative ligand	Formula	Smiles
The Class containing this family consists of a total of 322 families.
1	3PPR	Kd = 1.5 mM	4CS	C6 H10 N2 O2	CC1=N[C@@H....
2	3PPQ	Kd = 28 uM	CHT	C5 H14 N O	C[N+](C)(C....
3	5NXY	-	1Y8	C5 H14 As O	C[As](C)(C....
4	3R6U	Kd = 30.5 uM	CHT	C5 H14 N O	C[N+](C)(C....

Polypharmacology

Similar Ligands (2D)

Ligand no: 1; Ligand: 4CS; Similar ligands found: 1

No:	Ligand	ECFP6 Tc	MDL keys Tc
1	4CS	1	1

Similar Ligands (3D)

Ligand no: 1; Ligand: 4CS; Similar ligands found: 1388

No:	Ligand	Similarity coefficient
1	GAB	1.0000
2	NMJ	1.0000
3	3NT	1.0000
4	BRT	1.0000
5	8GC	1.0000
6	3HB	1.0000
7	3BZ	1.0000
8	3AB	1.0000
9	5HN	1.0000
10	WCE	1.0000
11	OVV	1.0000
12	53C	1.0000
13	3MB	0.9867
14	OVM	0.9849
15	OW4	0.9849
16	PCA	0.9815
17	MYJ	0.9804
18	3OC	0.9802
19	1P3	0.9801
20	DHB	0.9793
21	XX2	0.9792
22	4NC	0.9792
23	54G	0.9782
24	GTQ	0.9781
25	OXC	0.9781
26	5M0	0.9776
27	5RG	0.9774
28	NNO	0.9773
29	2HO	0.9770
30	QSB	0.9770
31	4A3	0.9767
32	J9T	0.9767
33	P9P	0.9767
34	93K	0.9766
35	FHB	0.9760
36	9TW	0.9753
37	CHB	0.9753
38	BEZ	0.9752
39	AW5	0.9751
40	3HM	0.9750
41	INO	0.9749
42	NIO	0.9746
43	ORO	0.9745
44	NCA	0.9744
45	3M0	0.9733
46	34D	0.9729
47	DBH	0.9727
48	VGL	0.9727
49	IHB	0.9726
50	NBZ	0.9723
51	FE DB1	0.9722
52	PZA	0.9722
53	5MK	0.9720
54	JLZ	0.9719
55	6CS	0.9717
56	6PC	0.9714
57	3HA	0.9713
58	2AL	0.9711
59	BE7	0.9710
60	3F0	0.9709
61	JBK	0.9709
62	UNU	0.9707
63	6M9	0.9701
64	BEN	0.9698
65	BAM	0.9698
66	SX1	0.9688
67	PBC	0.9688
68	7MU	0.9682
69	NTN	0.9679
70	DOR	0.9679
71	AC0	0.9677
72	51R	0.9671
73	OVP	0.9669
74	M58	0.9658
75	0RW	0.9653
76	F05	0.9648
77	TMH	0.9642
78	1P7	0.9641
79	9EW	0.9640
80	XCZ	0.9640
81	R8S	0.9636
82	FBW	0.9634
83	2K4	0.9633
84	069	0.9633
85	UGC	0.9631
86	YCP	0.9624
87	14O	0.9621
88	F60	0.9620
89	N5J	0.9616
90	3ID	0.9614
91	5H1	0.9613
92	M1E	0.9613
93	5SG	0.9611
94	9TZ	0.9611
95	5IQ	0.9607
96	OAA	0.9607
97	JBH	0.9604
98	DYA	0.9603
99	HPA	0.9599
100	SVN	0.9596
101	14J	0.9594
102	1SQ	0.9594
103	5MI	0.9590
104	XQ0	0.9588
105	JPZ	0.9588
106	1LQ	0.9586
107	PZI	0.9583
108	5MB	0.9582
109	5Q0	0.9578
110	6M4	0.9578
111	ES6	0.9577
112	ES1	0.9577
113	SS1	0.9575
114	BZX	0.9574
115	4YS	0.9573
116	SAL	0.9573
117	GUN	0.9570
118	BE2	0.9568
119	DMD	0.9567
120	MLT	0.9564
121	3U4	0.9560
122	45L	0.9555
123	4XH	0.9554
124	HQY	0.9551
125	GYE	0.9551
126	5B1	0.9548
127	HH8	0.9548
128	D1X	0.9545
129	1NP	0.9545
130	QSC	0.9545
131	11S	0.9544
132	BZ3	0.9544
133	4SV	0.9543
134	HHA	0.9540
135	ES9	0.9538
136	I3A	0.9537
137	5OB	0.9535
138	2A7	0.9531
139	7HQ	0.9527
140	HLZ	0.9525
141	MRZ	0.9524
142	ADZ	0.9521
143	BNS	0.9518
144	EA1	0.9515
145	UYA	0.9515
146	RSO	0.9515
147	7B4	0.9514
148	6AI	0.9511
149	FAN	0.9511
150	Q88	0.9510
151	23A	0.9510
152	10L	0.9508
153	6MP	0.9507
154	M4T	0.9505
155	Q6T	0.9505
156	PM6	0.9503
157	PHU	0.9502
158	AZA	0.9499
159	42C	0.9499
160	NIZ	0.9498
161	JKE	0.9497
162	H4N	0.9495
163	FK1	0.9494
164	7VS	0.9494
165	M0Q	0.9494
166	BP1	0.9492
167	UNC	0.9491
168	FQI	0.9490
169	FOT	0.9490
170	VNL	0.9490
171	ADE	0.9486
172	PRO	0.9484
173	COU	0.9483
174	24W	0.9483
175	7HP	0.9480
176	9DA	0.9477
177	A13	0.9476
178	7NI	0.9476
179	FGZ	0.9475
180	GAG	0.9474
181	AZ8	0.9473
182	AKH	0.9473
183	F31	0.9473
184	2AQ	0.9470
185	JBE	0.9470
186	OCH	0.9468
187	TEO	0.9467
188	OK7	0.9465
189	KBB	0.9464
190	M6N	0.9462
191	42A	0.9462
192	JB5	0.9461
193	ES0	0.9461
194	IJZ	0.9461
195	M0W	0.9461
196	RSF	0.9460
197	9MG	0.9459
198	9HX	0.9456
199	F0J	0.9456
200	LZM	0.9453
201	7WG	0.9452
202	KKN	0.9452
203	BTE	0.9452
204	DHK	0.9452
205	4FS	0.9450
206	BHO	0.9450
207	NPY	0.9450
208	1DW	0.9449
209	03V	0.9447
210	GBD	0.9445
211	2CK	0.9445
212	CFI	0.9445
213	J9W	0.9442
214	5RN	0.9442
215	AZG	0.9441
216	QUZ	0.9440
217	AX7	0.9439
218	GDE	0.9438
219	FA0	0.9437
220	DOB	0.9437
221	PE0	0.9437
222	QSH	0.9436
223	ES5	0.9434
224	60P	0.9434
225	KT7	0.9433
226	141	0.9433
227	3AL	0.9433
228	270	0.9432
229	DIN	0.9432
230	X0V	0.9432
231	ABV	0.9430
232	I1E	0.9430
233	SS2	0.9430
234	8NY	0.9424
235	A2F	0.9423
236	2D0	0.9423
237	ISZ	0.9423
238	V55	0.9422
239	4XR	0.9421
240	ASC	0.9420
241	Q24	0.9419
242	BHA	0.9418
243	QWN	0.9418
244	XAN	0.9417
245	5NU	0.9416
246	ES2	0.9416
247	CWM	0.9416
248	IFP	0.9416
249	7WV	0.9414
250	1XN	0.9413
251	PDC	0.9412
252	YH7	0.9411
253	MEW	0.9409
254	VGD	0.9408
255	6AP	0.9408
256	C2U	0.9408
257	HSO	0.9408
258	LMR	0.9408
259	OXQ	0.9407
260	HQJ	0.9405
261	ISN	0.9403
262	ES7	0.9403
263	4FH	0.9403
264	AQO	0.9402
265	A7W	0.9402
266	36R	0.9402
267	PHB	0.9402
268	VNJ	0.9402
269	C2A	0.9402
270	GIF	0.9401
271	DHS	0.9401
272	5AC	0.9400
273	2MI	0.9400
274	S76	0.9398
275	92K	0.9397
276	DBX	0.9396
277	4M0	0.9395
278	9DG	0.9394
279	MRW	0.9394
280	67N	0.9394
281	1P8	0.9393
282	MUA	0.9393
283	4HC	0.9392
284	ES4	0.9392
285	1WD	0.9391
286	7WA	0.9389
287	QXW	0.9388
288	NPO	0.9387
289	TIU	0.9383
290	5XC	0.9380
291	URP	0.9379
292	BOA	0.9377
293	URC	0.9377
294	M1H	0.9377
295	CRN	0.9377
296	M5K	0.9376
297	5WV	0.9376
298	IDM	0.9376
299	C21	0.9375
300	5HY	0.9373
301	5CU	0.9372
302	AHR	0.9372
303	ASP	0.9372
304	CLW	0.9371
305	DBJ	0.9370
306	2PC	0.9370
307	HMH	0.9369
308	K5W	0.9369
309	E7Z	0.9369
310	5JQ	0.9369
311	4Z4	0.9369
312	HX3	0.9369
313	ICO	0.9368
314	3FH	0.9368
315	FBU	0.9368
316	AJ2	0.9366
317	HJP	0.9366
318	HBD	0.9365
319	826	0.9365
320	1Y6	0.9365
321	290	0.9364
322	JBN	0.9364
323	FBB	0.9362
324	DEN	0.9361
325	2DR	0.9360
326	2HQ	0.9359
327	PAB	0.9359
328	3IT	0.9358
329	PBZ	0.9356
330	BTY	0.9356
331	HBX	0.9356
332	CFP	0.9355
333	ET2	0.9355
334	EYK	0.9355
335	2TQ	0.9354
336	FYU	0.9352
337	XAZ	0.9350
338	HY3	0.9350
339	1XM	0.9349
340	4MA	0.9347
341	4AA	0.9346
342	M1A	0.9346
343	JZ7	0.9346
344	AGK	0.9345
345	TFB	0.9345
346	IGA	0.9344
347	3XX	0.9344
348	DAS	0.9342
349	265	0.9340
350	PMB	0.9340
351	SHA	0.9340
352	SW7	0.9339
353	K2T	0.9339
354	EKZ	0.9339
355	JA8	0.9337
356	EDR	0.9337
357	SKM	0.9337
358	7W4	0.9334
359	FBM	0.9334
360	54D	0.9333
361	GJZ	0.9333
362	IND	0.9332
363	LZ1	0.9332
364	75K	0.9332
365	JFJ	0.9332
366	TP5	0.9330
367	P3K	0.9328
368	MPI	0.9327
369	97T	0.9327
370	IQ0	0.9327
371	HLR	0.9326
372	P92	0.9325
373	DIU	0.9325
374	ASN	0.9325
375	PYF	0.9324
376	3R6	0.9323
377	0R1	0.9322
378	DE5	0.9321
379	COI	0.9321
380	86J	0.9320
381	0CU	0.9320
382	GVH	0.9319
383	A29	0.9319
384	KUF	0.9317
385	PY7	0.9317
386	SE2	0.9316
387	URF	0.9316
388	L5V	0.9315
389	SYN	0.9314
390	DX4	0.9311
391	AC6	0.9310
392	XQG	0.9309
393	8G0	0.9308
394	QY9	0.9308
395	IP0	0.9308
396	M1Q	0.9306
397	F9P	0.9306
398	282	0.9305
399	G3E	0.9304
400	3PF	0.9304
401	JZ5	0.9304
402	H42	0.9303
403	FB2	0.9301
404	LNR	0.9301
405	HY1	0.9301
406	BZF	0.9299
407	KOJ	0.9299
408	MJ2	0.9299
409	2RH	0.9298
410	3HP	0.9296
411	174	0.9295
412	J5I	0.9292
413	0P6	0.9292
414	8CM	0.9291
415	4ZC	0.9288
416	Z82	0.9287
417	IT2	0.9286
418	0HO	0.9286
419	R9S	0.9286
420	SMV	0.9285
421	1WG	0.9284
422	4P5	0.9284
423	TAR	0.9284
424	2YU	0.9283
425	FEH	0.9282
426	ABN	0.9282
427	CWS	0.9281
428	32X	0.9281
429	HQT	0.9280
430	0W8	0.9280
431	BZI	0.9279
432	D48	0.9279
433	5VM	0.9279
434	G5V	0.9279
435	2CQ	0.9278
436	B55	0.9277
437	TH7	0.9277
438	JZ9	0.9276
439	8TX	0.9276
440	5JL	0.9276
441	4JT	0.9276
442	NBE	0.9274
443	MO8	0.9274
444	NK	0.9273
445	4ZE	0.9273
446	51F	0.9273
447	7W1	0.9269
448	7N0	0.9269
449	TZC	0.9269
450	5QX	0.9268
451	AS3	0.9268
452	PD2	0.9267
453	TLA	0.9264
454	MWM	0.9263
455	DRL	0.9263
456	4SX	0.9263
457	WBU	0.9262
458	DA4	0.9261
459	273	0.9261
460	3NY	0.9259
461	DNF	0.9258
462	150	0.9257
463	TZE	0.9257
464	2XX	0.9257
465	1DJ	0.9256
466	J9Q	0.9255
467	F12	0.9255
468	URA	0.9255
469	1DV	0.9255
470	M2K	0.9254
471	SRT	0.9253
472	47J	0.9253
473	RIB	0.9253
474	0HN	0.9252
475	6OT	0.9252
476	TDR	0.9251
477	F81	0.9250
478	6RQ	0.9250
479	G4D	0.9250
480	4M4	0.9249
481	EUG	0.9249
482	OHP	0.9248
483	271	0.9248
484	2ZM	0.9247
485	FBV	0.9246
486	TM7	0.9245
487	RNT	0.9245
488	173	0.9242
489	CXF	0.9240
490	AMC	0.9240
491	APY	0.9237
492	MNN	0.9236
493	FA1	0.9236
494	8EZ	0.9235
495	2AK	0.9234
496	8IG	0.9233
497	XLS	0.9233
498	PYC	0.9232
499	OW7	0.9232
500	MR1	0.9232
501	TPA	0.9232
502	GZL	0.9231
503	FPI	0.9231
504	K34	0.9230
505	EV0	0.9230
506	LT2	0.9229
507	PRZ	0.9229
508	2HU	0.9228
509	HT4	0.9228
510	AL0	0.9228
511	IT9	0.9228
512	GV9	0.9226
513	6NT	0.9223
514	AZ9	0.9223
515	DFB	0.9223
516	NFQ	0.9222
517	4HM	0.9221
518	OMD	0.9221
519	HH5	0.9219
520	3DO	0.9219
521	RM1	0.9216
522	XBT	0.9216
523	PAC	0.9216
524	FB1	0.9216
525	IFM	0.9215
526	0CT	0.9213
527	275	0.9213
528	2MP	0.9212
529	42J	0.9211
530	PRS	0.9210
531	FOA	0.9209
532	ABI	0.9208
533	MCT	0.9207
534	HQD	0.9207
535	MT0	0.9207
536	RCO	0.9206
537	1MR	0.9206
538	34A	0.9205
539	3Z7	0.9204
540	XM0	0.9204
541	F9Y	0.9203
542	4WL	0.9203
543	4ZA	0.9203
544	HIS	0.9203
545	0R0	0.9201
546	4XV	0.9200
547	O7U	0.9200
548	JAB	0.9197
549	2AC	0.9197
550	5JC	0.9196
551	3Z8	0.9196
552	CWJ	0.9195
553	VXX	0.9195
554	5FX	0.9195
555	GLY GLY	0.9194
556	JZ3	0.9193
557	ZZ3	0.9192
558	GTR	0.9192
559	4P0	0.9192
560	UFV	0.9192
561	QIC	0.9192
562	XYD	0.9191
563	B2J	0.9191
564	4RW	0.9190
565	DGJ	0.9190
566	CRS	0.9189
567	3SK	0.9189
568	M2H	0.9188
569	KTA	0.9188
570	GLU	0.9187
571	SAF	0.9185
572	1LN	0.9185
573	4NG	0.9185
574	4ME	0.9184
575	5UC	0.9184
576	IF7	0.9184
577	495	0.9182
578	OXZ	0.9182
579	AKG	0.9182
580	XBZ	0.9181
581	IOM	0.9181
582	0F9	0.9180
583	L3Q	0.9180
584	4H2	0.9180
585	HGQ	0.9179
586	HZP	0.9176
587	4JJ	0.9175
588	PKU	0.9174
589	XUL	0.9174
590	A1U	0.9173
591	3CH	0.9173
592	45C	0.9171
593	BSX	0.9171
594	VAH	0.9170
595	1LM	0.9170
596	6NI	0.9169
597	27Y	0.9169
598	5XB	0.9169
599	5NI	0.9168
600	M3T	0.9167
601	AJV	0.9167
602	463	0.9167
603	ICP	0.9166
604	PYD	0.9166
605	SVD	0.9166
606	26D	0.9166
607	ISD	0.9165
608	0N7	0.9164
609	XYL	0.9164
610	RB5	0.9164
611	RB0	0.9164
612	261	0.9164
613	1MC	0.9163
614	HZQ	0.9163
615	JAW	0.9162
616	RNS	0.9162
617	MWP	0.9161
618	HIO	0.9160
619	ZXD	0.9159
620	3A9	0.9157
621	GRE	0.9157
622	TH0	0.9157
623	MWJ	0.9157
624	HBA	0.9157
625	4HO	0.9156
626	CCB	0.9156
627	THE	0.9155
628	4JP	0.9154
629	1AL	0.9154
630	PEA	0.9153
631	92P	0.9152
632	9CL	0.9151
633	LG3	0.9151
634	LYL	0.9150
635	1PT	0.9149
636	MAQ	0.9148
637	1F1	0.9147
638	D07	0.9147
639	HYP	0.9147
640	GAL	0.9146
641	4XS	0.9145
642	8WT	0.9144
643	4CL	0.9144
644	MZG	0.9144
645	7CZ	0.9143
646	HL5	0.9141
647	0TU	0.9139
648	TC7	0.9139
649	2LY	0.9139
650	SKA	0.9139
651	CMS	0.9139
652	MQN	0.9138
653	43M	0.9138
654	8WO	0.9138
655	MUC	0.9136
656	1DU	0.9135
657	JAE	0.9134
658	J1Z	0.9133
659	CIG	0.9132
660	SD4	0.9132
661	AC5	0.9131
662	JZ2	0.9130
663	C2Y	0.9130
664	DIE	0.9130
665	PEP	0.9130
666	N7P	0.9130
667	QPR	0.9129
668	MXN	0.9129
669	ITN	0.9128
670	XRG	0.9126
671	JZ4	0.9126
672	23W	0.9125
673	B3R	0.9125
674	XHP	0.9124
675	B60	0.9124
676	44W	0.9123
677	BVF	0.9123
678	SJ5	0.9123
679	7WR	0.9123
680	263	0.9123
681	DQU	0.9122
682	7A8	0.9121
683	HMU	0.9121
684	OTW	0.9120
685	5WX	0.9117
686	69O	0.9117
687	FP1	0.9117
688	ADA	0.9116
689	URQ	0.9115
690	PRY	0.9115
691	4JQ	0.9114
692	15L	0.9112
693	94W	0.9109
694	HEW	0.9109
695	TLD	0.9109
696	LDP	0.9109
697	CYT	0.9109
698	PSE	0.9108
699	NCD	0.9108
700	LG5	0.9107
701	OHG	0.9104
702	GCB	0.9104
703	L99	0.9103
704	2F6	0.9103
705	82I	0.9102
706	B24	0.9102
707	F4Z	0.9100
708	B62	0.9100
709	IV2	0.9100
710	2A9	0.9099
711	DIG	0.9098
712	284	0.9098
713	NXA	0.9098
714	4YO	0.9097
715	2ZV	0.9097
716	6F0	0.9097
717	HSE	0.9096
718	KYD	0.9095
719	DHQ	0.9095
720	HHQ	0.9095
721	6TZ	0.9095
722	BDP	0.9094
723	PEL	0.9093
724	6M1	0.9092
725	PYJ	0.9092
726	3DM	0.9091
727	FPY	0.9090
728	OEM	0.9089
729	VAL	0.9089
730	12Q	0.9088
731	717	0.9088
732	T9G	0.9088
733	QWW	0.9087
734	K6H	0.9087
735	RAT	0.9087
736	8GF	0.9085
737	FUM	0.9085
738	II6	0.9085
739	2EC	0.9082
740	44V	0.9080
741	5QY	0.9080
742	24B	0.9080
743	3SL	0.9079
744	XYP	0.9079
745	4MU	0.9077
746	RIP	0.9077
747	GLL	0.9077
748	HDH	0.9076
749	8OZ	0.9076
750	LSA	0.9076
751	G2F	0.9075
752	6GU	0.9074
753	APZ	0.9072
754	FBJ	0.9072
755	2PG	0.9072
756	GLC	0.9072
757	40E	0.9072
758	FCR	0.9071
759	2LP	0.9071
760	9RW	0.9071
761	ZZT	0.9070
762	QDK	0.9070
763	R8A	0.9070
764	BCP	0.9070
765	GLA	0.9069
766	X09	0.9069
767	XIY	0.9068
768	1M2	0.9067
769	GLY ALA	0.9066
770	EQT	0.9065
771	F5B	0.9065
772	98J	0.9065
773	EHM	0.9065
774	DUC	0.9065
775	HDA	0.9065
776	2CO	0.9064
777	NDH	0.9063
778	2H5	0.9063
779	DPR	0.9063
780	ILE	0.9062
781	THR	0.9062
782	SPA	0.9061
783	1DQ	0.9061
784	MS9	0.9060
785	WOT	0.9060
786	TSU	0.9060
787	EVA	0.9060
788	NSP	0.9056
789	KJH	0.9055
790	9X7	0.9055
791	5MH	0.9055
792	ONR	0.9055
793	5GU	0.9054
794	LEU	0.9054
795	0TR	0.9053
796	2FY	0.9052
797	6LW	0.9051
798	EDG	0.9051
799	6VD	0.9051
800	JDN	0.9050
801	N2I	0.9049
802	Y8I	0.9049
803	HXX	0.9049
804	T2C	0.9048
805	N8P	0.9047
806	286	0.9047
807	H7Y	0.9046
808	ZBT	0.9046
809	39A	0.9045
810	PRI	0.9045
811	R2B	0.9044
812	RAM	0.9044
813	GCU	0.9043
814	R20	0.9043
815	2ZX	0.9043
816	FA3	0.9043
817	P72	0.9042
818	BR9	0.9042
819	JYD	0.9042
820	Z6J	0.9041
821	RMN	0.9041
822	6JN	0.9040
823	FDB	0.9039
824	149	0.9039
825	G3F	0.9039
826	SIN	0.9039
827	KJU	0.9037
828	5WY	0.9037
829	XSP	0.9037
830	CN0	0.9036
831	E35	0.9035
832	NOJ	0.9035
833	SPV	0.9033
834	RBL	0.9032
835	LDU	0.9031
836	XXR	0.9031
837	NID	0.9030
838	CTL	0.9030
839	MVN	0.9029
840	DUB	0.9029
841	0FO	0.9028
842	BGC	0.9028
843	JB8	0.9027
844	N2Z	0.9027
845	ERH	0.9026
846	6UA	0.9026
847	1GP	0.9025
848	IUR	0.9023
849	INE	0.9022
850	DS0	0.9020
851	4JO	0.9020
852	R1X	0.9018
853	HPY	0.9017
854	OGA	0.9016
855	SEP	0.9015
856	IHG	0.9015
857	BK9	0.9014
858	BCU	0.9014
859	DQA	0.9014
860	4VP	0.9013
861	N8Y	0.9012
862	13X	0.9011
863	Z5P	0.9010
864	13P	0.9008
865	DTL	0.9007
866	7ZE	0.9006
867	52C	0.9006
868	G6D	0.9006
869	AHB	0.9004
870	ADK	0.9004
871	3MA	0.9004
872	TZL	0.9004
873	KJY	0.9003
874	5ZE	0.9003
875	TYL	0.9002
876	RHU	0.9002
877	UAN	0.9001
878	329	0.8998
879	JIF	0.8997
880	3WA	0.8997
881	ROR	0.8996
882	URS	0.8996
883	B57	0.8995
884	3HG	0.8995
885	M6W	0.8994
886	MAN	0.8994
887	25W	0.8994
888	6MH	0.8993
889	O72	0.8992
890	4TU	0.8992
891	AX2	0.8992
892	GXY	0.8992
893	GP9	0.8992
894	8K2	0.8991
895	2ZQ	0.8991
896	IDH	0.8991
897	SNE	0.8991
898	2FG	0.8990
899	8H8	0.8990
900	GLN	0.8989
901	SWA	0.8988
902	M4E	0.8987
903	BDR	0.8987
904	XXG	0.8987
905	CEE	0.8987
906	SMN	0.8987
907	2BG	0.8986
908	SAN	0.8986
909	DMJ	0.8986
910	MAE	0.8986
911	LNO	0.8986
912	ICF	0.8985
913	MAK	0.8984
914	5AN	0.8984
915	JBQ	0.8984
916	H76	0.8984
917	FBS	0.8983
918	BEA	0.8982
919	LER	0.8982
920	GIO	0.8981
921	IFL	0.8980
922	EOL	0.8980
923	X6X	0.8980
924	UY7	0.8980
925	CTS	0.8979
926	HCS	0.8978
927	KBG	0.8976
928	GIV	0.8975
929	MEV	0.8974
930	PYG	0.8974
931	TTL	0.8973
932	RUU	0.8973
933	AEH	0.8972
934	9FL	0.8970
935	1GN	0.8970
936	SR1	0.8969
937	R9M	0.8969
938	I2M	0.8968
939	YIO	0.8967
940	PEQ	0.8967
941	0V5	0.8967
942	ASO	0.8967
943	TM4	0.8967
944	HA7	0.8967
945	AFR	0.8966
946	SOE	0.8964
947	3AY	0.8962
948	6ME	0.8961
949	HLD	0.8961
950	AAS	0.8961
951	IPB	0.8957
952	SC2	0.8957
953	ARW	0.8957
954	3PG	0.8956
955	PXL	0.8955
956	O2A	0.8955
957	PAF	0.8955
958	FPK	0.8953
959	H3M	0.8952
960	PA1	0.8952
961	BP9	0.8951
962	LGC	0.8951
963	NMG	0.8950
964	2AS	0.8950
965	I4B	0.8949
966	SYV	0.8948
967	DHR	0.8948
968	MBD	0.8948
969	T6C	0.8948
970	280	0.8947
971	DYT	0.8946
972	KIV	0.8946
973	4J8	0.8945
974	HX2	0.8944
975	PIY	0.8943
976	LRH	0.8943
977	2MY	0.8941
978	7MH	0.8941
979	DHI	0.8939
980	AZF	0.8939
981	8S0	0.8939
982	8ZE	0.8937
983	GAF	0.8937
984	FRU	0.8937
985	3V4	0.8937
986	JND	0.8936
987	NOY	0.8936
988	TCZ	0.8935
989	AEF	0.8935
990	TSS	0.8935
991	4NM	0.8933
992	ANN	0.8932
993	9CA	0.8932
994	5RO	0.8932
995	WDL	0.8931
996	AN0	0.8931
997	3CE	0.8931
998	TWO	0.8930
999	LLQ	0.8930
1000	AMS	0.8929
1001	PPR	0.8929
1002	TOF	0.8928
1003	LCN	0.8928
1004	PEZ	0.8927
1005	0LH	0.8927
1006	12M	0.8927
1007	K7M	0.8927
1008	IMR	0.8926
1009	AH8	0.8926
1010	0MK	0.8926
1011	MBG	0.8924
1012	LXC	0.8924
1013	XYS	0.8924
1014	SHF	0.8923
1015	R67	0.8923
1016	KP6	0.8923
1017	OTR	0.8923
1018	BR8	0.8922
1019	RJY	0.8921
1020	4JM	0.8921
1021	1IT	0.8919
1022	HPS	0.8918
1023	GZ3	0.8918
1024	PHE	0.8918
1025	SXS	0.8917
1026	FH2	0.8917
1027	JZ1	0.8917
1028	JXN	0.8914
1029	258	0.8914
1030	VOH	0.8914
1031	6FZ	0.8914
1032	G3H	0.8913
1033	G3P	0.8913
1034	NQ	0.8911
1035	ALL	0.8911
1036	ZWZ	0.8911
1037	A09	0.8911
1038	HA5	0.8910
1039	PGH	0.8910
1040	RD4	0.8910
1041	MEQ	0.8910
1042	3MC	0.8909
1043	IPZ	0.8909
1044	TGX	0.8907
1045	PBE	0.8907
1046	PIM	0.8906
1047	2CM	0.8905
1048	YSO	0.8905
1049	FLM	0.8903
1050	H8N	0.8902
1051	23J	0.8902
1052	MNM	0.8901
1053	2CL	0.8901
1054	WOO	0.8900
1055	1AB	0.8900
1056	GLY CYS	0.8899
1057	152	0.8899
1058	TBP	0.8898
1059	GRO	0.8898
1060	1SA	0.8897
1061	G2H	0.8897
1062	PYQ	0.8894
1063	3C4	0.8894
1064	CIT	0.8892
1065	HSM	0.8891
1066	FBT	0.8890
1067	9KH	0.8890
1068	KLW	0.8888
1069	SF6	0.8888
1070	0GZ	0.8886
1071	VK3	0.8886
1072	FDK	0.8886
1073	TAG	0.8886
1074	KIB	0.8886
1075	DHY	0.8885
1076	2FQ	0.8884
1077	34V	0.8884
1078	95Z	0.8884
1079	FBA	0.8883
1080	ZZ8	0.8882
1081	4MV	0.8882
1082	BZ2	0.8881
1083	9FE	0.8881
1084	GUA	0.8881
1085	GMN	0.8879
1086	IPM	0.8879
1087	FUL	0.8879
1088	9R5	0.8878
1089	9YL	0.8877
1090	GCS	0.8877
1091	CSS	0.8877
1092	4AV	0.8876
1093	64K	0.8876
1094	94N	0.8874
1095	0JD	0.8872
1096	259	0.8872
1097	CIZ	0.8872
1098	TEP	0.8870
1099	SHG	0.8870
1100	S2G	0.8870
1101	GLY PRO	0.8866
1102	9PY	0.8866
1103	39O	0.8865
1104	DNC	0.8865
1105	M1Z	0.8864
1106	MRY	0.8863
1107	RXA	0.8862
1108	SF9	0.8861
1109	DGL	0.8860
1110	X05	0.8859
1111	BMA	0.8858
1112	4FA	0.8858
1113	PLQ	0.8855
1114	XX3	0.8855
1115	2C9	0.8854
1116	IZC	0.8854
1117	TRC	0.8854
1118	DEE	0.8853
1119	FUF	0.8853
1120	449	0.8853
1121	N4B	0.8851
1122	MZB	0.8850
1123	KPL	0.8850
1124	3MH	0.8849
1125	R9Y	0.8845
1126	MLA	0.8843
1127	4JL	0.8840
1128	YHO	0.8839
1129	ONL	0.8835
1130	QMP	0.8834
1131	AX3	0.8834
1132	PQ0	0.8833
1133	OAF	0.8831
1134	GOO	0.8831
1135	B53	0.8830
1136	MLI	0.8830
1137	NTM	0.8829
1138	XDE	0.8828
1139	PNZ	0.8828
1140	PHT	0.8827
1141	PMF	0.8824
1142	KFH	0.8824
1143	NYL	0.8824
1144	ORN	0.8823
1145	ICC	0.8823
1146	2EH	0.8823
1147	2HG	0.8822
1148	1KP	0.8821
1149	NDM	0.8821
1150	OTD	0.8820
1151	FLA	0.8820
1152	BVC	0.8819
1153	FUB	0.8819
1154	2IT	0.8817
1155	XXP	0.8817
1156	FFP	0.8816
1157	DFU	0.8816
1158	0W1	0.8815
1159	ODO	0.8815
1160	ABE	0.8814
1161	NVI	0.8813
1162	DCL	0.8813
1163	KDF	0.8813
1164	SYG	0.8812
1165	AJY	0.8809
1166	GXL	0.8808
1167	3FA	0.8808
1168	HC4	0.8808
1169	APG	0.8807
1170	9TY	0.8807
1171	20J	0.8806
1172	SRO	0.8803
1173	AUD	0.8803
1174	ICB	0.8802
1175	ARB	0.8802
1176	PEY	0.8801
1177	2FT	0.8801
1178	N3W	0.8801
1179	MPV	0.8800
1180	BNF	0.8798
1181	EXO	0.8795
1182	CDV	0.8795
1183	ALO	0.8795
1184	FPN	0.8794
1185	HQE	0.8794
1186	FX1	0.8794
1187	SOR	0.8794
1188	MET	0.8793
1189	MZ0	0.8793
1190	BEW	0.8791
1191	YRL	0.8790
1192	FUD	0.8790
1193	DA1	0.8788
1194	JUG	0.8787
1195	8EW	0.8787
1196	LFR	0.8787
1197	M45	0.8786
1198	PQK	0.8786
1199	9X6	0.8786
1200	MZW	0.8784
1201	SYC	0.8784
1202	3BU	0.8782
1203	FW5	0.8782
1204	G1O	0.8781
1205	15E	0.8780
1206	PAH	0.8780
1207	PBA	0.8780
1208	GLO	0.8778
1209	SN4	0.8778
1210	TRA	0.8775
1211	AOS	0.8775
1212	FUC	0.8775
1213	QFH	0.8775
1214	BVG	0.8774
1215	QUS	0.8772
1216	RPQ	0.8771
1217	PXY	0.8770
1218	PRA	0.8770
1219	MFB	0.8770
1220	PCR	0.8768
1221	NLE	0.8768
1222	IWT	0.8768
1223	SYA	0.8768
1224	40O	0.8767
1225	UEG	0.8766
1226	J9N	0.8766
1227	BDF	0.8765
1228	NVA	0.8765
1229	4SD	0.8764
1230	R8V	0.8764
1231	4V2	0.8763
1232	GNL	0.8763
1233	3ZQ	0.8763
1234	1XX	0.8762
1235	B40	0.8761
1236	I6G	0.8760
1237	OSE	0.8759
1238	ECE	0.8759
1239	15N	0.8758
1240	ARA	0.8758
1241	MAJ	0.8757
1242	Q7A	0.8757
1243	L22	0.8753
1244	TTY	0.8751
1245	KMH	0.8751
1246	J6W	0.8750
1247	TT4	0.8750
1248	264	0.8750
1249	B85	0.8749
1250	KIA	0.8747
1251	2CH	0.8745
1252	EMZ	0.8745
1253	PSV	0.8743
1254	B5D	0.8743
1255	3MG	0.8740
1256	KMT	0.8737
1257	NVU	0.8736
1258	SDD	0.8736
1259	LG4	0.8735
1260	12B	0.8734
1261	JFD	0.8733
1262	M44	0.8733
1263	FCA	0.8730
1264	8XL	0.8729
1265	C2B	0.8729
1266	PGA	0.8729
1267	NGO	0.8727
1268	HVQ	0.8727
1269	3PY	0.8727
1270	AHN	0.8725
1271	RUY	0.8725
1272	ESI	0.8722
1273	MLE	0.8721
1274	2KT	0.8720
1275	C5J	0.8718
1276	285	0.8718
1277	QAS	0.8717
1278	NGT	0.8717
1279	MFU	0.8717
1280	GVG	0.8717
1281	MLM	0.8716
1282	JKZ	0.8712
1283	MD0	0.8712
1284	091	0.8707
1285	SSN	0.8706
1286	CFF	0.8706
1287	FLC	0.8706
1288	24T	0.8705
1289	0OC	0.8703
1290	NCT	0.8702
1291	PRF	0.8701
1292	K17	0.8700
1293	E5X	0.8700
1294	CEJ	0.8699
1295	CH9	0.8697
1296	2MH	0.8696
1297	4CH	0.8693
1298	3QM	0.8692
1299	35C	0.8691
1300	4VY	0.8691
1301	32O	0.8690
1302	AY4	0.8687
1303	SYM	0.8686
1304	7B3	0.8685
1305	DEW	0.8685
1306	NEQ	0.8685
1307	BML	0.8683
1308	9KT	0.8682
1309	SIF	0.8681
1310	ICT	0.8676
1311	4JU	0.8676
1312	PFL	0.8675
1313	OXE	0.8674
1314	HHH	0.8674
1315	SEJ	0.8673
1316	3YP	0.8672
1317	MSR	0.8671
1318	PXM	0.8671
1319	CPZ	0.8666
1320	RM4	0.8665
1321	GOX	0.8664
1322	IPH	0.8664
1323	CAQ	0.8663
1324	H62	0.8662
1325	BPN	0.8660
1326	KG7	0.8660
1327	41K	0.8659
1328	P84	0.8657
1329	KDG	0.8654
1330	8XQ	0.8652
1331	ZB1	0.8650
1332	AAE	0.8649
1333	FK8	0.8648
1334	278	0.8647
1335	SKJ	0.8647
1336	6R8	0.8644
1337	FCB	0.8644
1338	MED	0.8638
1339	INS	0.8634
1340	3C7	0.8628
1341	JF6	0.8628
1342	QX2	0.8623
1343	E7S	0.8622
1344	DTT	0.8622
1345	EGR	0.8621
1346	JTH	0.8620
1347	P4B	0.8620
1348	GG6	0.8617
1349	2IM	0.8616
1350	DZX	0.8615
1351	6HQ	0.8614
1352	GOJ	0.8613
1353	PH2	0.8611
1354	H95	0.8609
1355	PJW	0.8607
1356	AMG	0.8605
1357	7VJ	0.8604
1358	LKA	0.8602
1359	C5A	0.8601
1360	4HP	0.8601
1361	QX4	0.8599
1362	AIN	0.8598
1363	QBK	0.8592
1364	HHR	0.8592
1365	ZGL	0.8592
1366	1X7	0.8591
1367	HCI	0.8586
1368	GF4	0.8581
1369	RBJ	0.8578
1370	I1N	0.8576
1371	V6F	0.8567
1372	PFB	0.8565
1373	61M	0.8565
1374	GBN	0.8565
1375	3MV	0.8565
1376	W81	0.8565
1377	GCO	0.8565
1378	KYA	0.8564
1379	7UC	0.8562
1380	3RK	0.8558
1381	MMA	0.8555
1382	OA3	0.8554
1383	7MK	0.8553
1384	WTZ	0.8552
1385	1SP	0.8549
1386	EN1	0.8531
1387	1U6	0.8530
1388	LAO	0.8519

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

Pocket No.: 1; Query (leader) PDB : 3PPQ; Ligand: CHT; 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: 3ppq.bio1) has 9 residues
No:	Leader PDB	Ligand	Sequence Similarity

Pocket No.: 2; Query (leader) PDB : 3PPQ; Ligand: CHT; 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: 3ppq.bio2) has 10 residues
No:	Leader PDB	Ligand	Sequence Similarity

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