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Receptor

PDB id	Resolution	Class	Description	Source	Keywords
2QVZ	2.5 Å	EC: 6.2.1.33	4-CHLOROBENZOYL-COA LIGASE/SYNTHETASE, I303A MUTATION, BOUND CHLOROBENZOATE	ALCALIGENES SP.	ADENYLATE-FORMING ENZYMES ACYL-COA LIGASE LIGASE
Ref.:	RATIONAL REDESIGN OF THE 4-CHLOROBENZOATE BINDING S 4-CHLOROBENZOATE: COENZYME A LIGASE FOR EXPANDED SU RANGE. BIOCHEMISTRY V. 46 14487 2007

Ligand

Ligand	Chain:Residue	Validity	Ligand Warnings	Binding Data	NGL Viewer	Molecular Weight (Da)	Formula	SMILES
3BZ	X:505;	Valid;	none;	submit data		156.566	C7 H5 Cl O2	c1cc(...

View in 3D viewer

90% Homology Family

Leader

PDB id	Resolution	Class	Description	Source	Keywords
3CW9	2 Å	EC: 6.2.1.33	4-CHLOROBENZOYL-COA LIGASE/SYNTHETASE IN THE THIOESTER-FORMI CONFORMATION, BOUND TO 4-CHLOROPHENACYL-COA	ALCALIGENES SP.	ADENYLATE-FORMING ENZYMES ACYL-COA LIGASE DOMAIN ALTERNATILIGASE
Ref.:	STRUCTURAL CHARACTERIZATION OF A 140 DEGREES DOMAIN IN THE TWO-STEP REACTION CATALYZED BY 4-CHLOROBENZO LIGASE. BIOCHEMISTRY V. 47 8016 2008

Members (4)

No:	PDB id	Binding Data	Representative ligand	Formula	Smiles
The Class containing this family consists of a total of 1 families.
1	3CW9	-	AMP	C10 H14 N5 O7 P	c1nc(c2c(n....
2	1T5D	-	174	C7 H5 Cl O2	c1cc(ccc1C....
3	2QVZ	-	3BZ	C7 H5 Cl O2	c1cc(cc(c1....
4	3CW8	-	00A	C17 H17 Cl N5 O8 P	c1cc(ccc1C....

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	3CW9	-	AMP	C10 H14 N5 O7 P	c1nc(c2c(n....
2	1T5D	-	174	C7 H5 Cl O2	c1cc(ccc1C....
3	2QVZ	-	3BZ	C7 H5 Cl O2	c1cc(cc(c1....
4	3CW8	-	00A	C17 H17 Cl N5 O8 P	c1cc(ccc1C....

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	3CW9	-	AMP	C10 H14 N5 O7 P	c1nc(c2c(n....
2	1T5D	-	174	C7 H5 Cl O2	c1cc(ccc1C....
3	2QVZ	-	3BZ	C7 H5 Cl O2	c1cc(cc(c1....
4	3CW8	-	00A	C17 H17 Cl N5 O8 P	c1cc(ccc1C....

Polypharmacology

Similar Ligands (2D)

Ligand no: 1; Ligand: 3BZ; Similar ligands found: 5

No:	Ligand	ECFP6 Tc	MDL keys Tc
1	3BZ	1	1
2	OVV	0.485714	0.625
3	174	0.411765	1
4	BEZ	0.40625	0.666667
5	3CH	0.40625	0.666667

Similar Ligands (3D)

Ligand no: 1; Ligand: 3BZ; Similar ligands found: 1192

No:	Ligand	Similarity coefficient
1	NMJ	1.0000
2	WCE	1.0000
3	BRT	1.0000
4	8GC	1.0000
5	4CS	1.0000
6	3HB	1.0000
7	53C	1.0000
8	3AB	0.9997
9	GAB	0.9983
10	3NT	0.9977
11	5HN	0.9933
12	3OC	0.9740
13	1P3	0.9689
14	3MB	0.9688
15	P9P	0.9683
16	6CS	0.9663
17	NCA	0.9658
18	QSB	0.9655
19	IHB	0.9650
20	6PC	0.9647
21	ORO	0.9647
22	3F0	0.9646
23	54G	0.9645
24	4NC	0.9644
25	5RG	0.9643
26	7MU	0.9638
27	OW4	0.9634
28	MYJ	0.9631
29	DBH	0.9629
30	YCP	0.9627
31	GTQ	0.9626
32	CHB	0.9625
33	HHA	0.9624
34	BEN	0.9624
35	PBC	0.9622
36	OVM	0.9620
37	OVP	0.9615
38	DHB	0.9613
39	NIO	0.9607
40	4A3	0.9605
41	J9T	0.9601
42	3M0	0.9600
43	3HA	0.9599
44	5M0	0.9599
45	3HM	0.9599
46	BAM	0.9595
47	NBZ	0.9595
48	9TZ	0.9594
49	JBK	0.9591
50	PZA	0.9588
51	UNU	0.9581
52	INO	0.9579
53	JLZ	0.9578
54	OAA	0.9576
55	VGL	0.9571
56	5MK	0.9567
57	AC0	0.9564
58	SAL	0.9564
59	MLT	0.9563
60	FHB	0.9557
61	2HO	0.9556
62	OXC	0.9555
63	5OB	0.9554
64	NNO	0.9553
65	6M9	0.9552
66	9TW	0.9549
67	93K	0.9549
68	GYE	0.9548
69	AW5	0.9537
70	1P7	0.9533
71	XX2	0.9532
72	BE2	0.9525
73	NTN	0.9518
74	M1E	0.9518
75	SS1	0.9517
76	SX1	0.9516
77	2AL	0.9513
78	D1X	0.9513
79	0RW	0.9511
80	QSC	0.9509
81	45L	0.9509
82	51R	0.9505
83	14J	0.9503
84	BZ3	0.9495
85	PZI	0.9484
86	DOR	0.9476
87	6M4	0.9475
88	FE DB1	0.9474
89	3ID	0.9474
90	5B1	0.9472
91	7B4	0.9471
92	FBW	0.9465
93	JZ7	0.9462
94	BE7	0.9462
95	34D	0.9459
96	5H1	0.9455
97	5MB	0.9452
98	F60	0.9450
99	F05	0.9447
100	AHR	0.9445
101	DYA	0.9445
102	4SV	0.9444
103	3DO	0.9443
104	F31	0.9443
105	XQ0	0.9442
106	SVN	0.9441
107	BZX	0.9439
108	069	0.9438
109	GUN	0.9437
110	9EW	0.9435
111	I3A	0.9434
112	H42	0.9434
113	6AI	0.9433
114	PDC	0.9433
115	XCZ	0.9431
116	14O	0.9426
117	ES6	0.9426
118	GDE	0.9419
119	3U4	0.9417
120	DMD	0.9417
121	BNS	0.9415
122	VNL	0.9405
123	R8S	0.9404
124	ES9	0.9404
125	C2U	0.9404
126	FK1	0.9403
127	RM1	0.9402
128	CFI	0.9399
129	ADE	0.9399
130	42A	0.9398
131	M58	0.9396
132	H4N	0.9391
133	DHK	0.9391
134	M0Q	0.9389
135	9DG	0.9387
136	BHO	0.9386
137	LZM	0.9386
138	JFJ	0.9385
139	11S	0.9384
140	7VS	0.9384
141	5MI	0.9383
142	LMR	0.9383
143	1LQ	0.9383
144	PCA	0.9382
145	NIZ	0.9377
146	ISZ	0.9373
147	FAN	0.9373
148	FQI	0.9372
149	2AQ	0.9371
150	2K4	0.9367
151	QSH	0.9367
152	HPA	0.9364
153	1NP	0.9364
154	BOA	0.9363
155	JKE	0.9363
156	TIU	0.9357
157	COU	0.9357
158	C2A	0.9356
159	KKN	0.9356
160	YH7	0.9355
161	1SQ	0.9354
162	3AL	0.9352
163	PHB	0.9352
164	UNC	0.9351
165	N5J	0.9349
166	XAN	0.9348
167	ADZ	0.9348
168	QUZ	0.9347
169	NPO	0.9345
170	1DW	0.9345
171	M1H	0.9343
172	8NY	0.9341
173	1XM	0.9340
174	IT2	0.9339
175	OCH	0.9339
176	RSF	0.9338
177	7WG	0.9335
178	HLZ	0.9332
179	AZA	0.9332
180	DIU	0.9331
181	4FS	0.9331
182	6MP	0.9331
183	2DR	0.9329
184	SKM	0.9328
185	HQJ	0.9328
186	M6N	0.9328
187	PAB	0.9327
188	MEW	0.9327
189	5XC	0.9326
190	6AP	0.9326
191	ASC	0.9325
192	5IQ	0.9324
193	JB5	0.9324
194	SS2	0.9323
195	QWN	0.9323
196	A13	0.9322
197	2HQ	0.9322
198	4HM	0.9321
199	IGA	0.9320
200	GZL	0.9316
201	HSO	0.9315
202	24W	0.9314
203	1P8	0.9314
204	7WV	0.9314
205	JBE	0.9313
206	RSO	0.9313
207	AL0	0.9312
208	M5K	0.9312
209	4XH	0.9310
210	GAG	0.9308
211	IFM	0.9305
212	Q6T	0.9305
213	7HQ	0.9304
214	MR1	0.9304
215	9MG	0.9304
216	03V	0.9303
217	S76	0.9303
218	Q88	0.9302
219	IND	0.9302
220	QXW	0.9298
221	4YS	0.9298
222	4ZC	0.9297
223	Z82	0.9296
224	ES5	0.9295
225	KOJ	0.9294
226	FBM	0.9294
227	4XR	0.9294
228	ISN	0.9294
229	VGD	0.9293
230	DEN	0.9293
231	COI	0.9292
232	A2F	0.9292
233	4FH	0.9291
234	NPY	0.9291
235	JPZ	0.9290
236	10L	0.9290
237	3Z7	0.9289
238	AJ2	0.9287
239	SJ5	0.9286
240	23A	0.9285
241	P72	0.9285
242	RB5	0.9284
243	XYL	0.9284
244	AZG	0.9284
245	HH8	0.9283
246	PE0	0.9283
247	FOT	0.9282
248	FPI	0.9282
249	1WD	0.9282
250	SYN	0.9282
251	HBD	0.9281
252	EA1	0.9281
253	HY3	0.9280
254	BZI	0.9278
255	ES1	0.9277
256	9DA	0.9277
257	1Y6	0.9276
258	DA4	0.9276
259	EYK	0.9276
260	LZ1	0.9276
261	HMH	0.9274
262	3PF	0.9273
263	AMC	0.9272
264	IDM	0.9272
265	TP5	0.9271
266	141	0.9270
267	ABN	0.9267
268	G3E	0.9267
269	5RN	0.9266
270	0W8	0.9263
271	FYU	0.9263
272	HX3	0.9262
273	C21	0.9262
274	URC	0.9262
275	ES4	0.9262
276	7NI	0.9260
277	HBX	0.9259
278	GBD	0.9257
279	5Q0	0.9257
280	CWM	0.9257
281	2CK	0.9256
282	ES7	0.9255
283	AQO	0.9255
284	9HX	0.9255
285	KBB	0.9254
286	1PT	0.9254
287	F0J	0.9253
288	X0V	0.9253
289	MUA	0.9253
290	LT2	0.9252
291	AZ8	0.9252
292	282	0.9252
293	5WV	0.9251
294	V55	0.9250
295	PBZ	0.9249
296	ES2	0.9248
297	SMV	0.9247
298	GLC	0.9247
299	XQG	0.9246
300	SVD	0.9245
301	4JT	0.9245
302	HQY	0.9245
303	PD2	0.9245
304	5QY	0.9245
305	2A7	0.9244
306	AKH	0.9242
307	5JQ	0.9241
308	PYF	0.9240
309	PM6	0.9240
310	2CQ	0.9240
311	DRL	0.9239
312	M2K	0.9239
313	SRT	0.9237
314	5SG	0.9237
315	3XX	0.9236
316	IJZ	0.9235
317	JBN	0.9235
318	HIS	0.9235
319	PRO	0.9234
320	AX7	0.9234
321	2PC	0.9233
322	7HP	0.9233
323	BGC	0.9233
324	FA0	0.9233
325	BP1	0.9231
326	BZF	0.9231
327	5CU	0.9229
328	5NU	0.9228
329	TZC	0.9228
330	GIF	0.9227
331	4MA	0.9227
332	TZE	0.9226
333	PRZ	0.9223
334	DBX	0.9223
335	ES0	0.9223
336	OXQ	0.9223
337	3R6	0.9221
338	PHU	0.9221
339	36R	0.9221
340	XBT	0.9221
341	MPI	0.9220
342	ABV	0.9220
343	OXZ	0.9219
344	IFP	0.9218
345	XAZ	0.9218
346	MNN	0.9217
347	PY7	0.9217
348	CFP	0.9216
349	290	0.9215
350	I1E	0.9214
351	BCP	0.9214
352	TH7	0.9214
353	HMU	0.9214
354	75K	0.9214
355	FGZ	0.9213
356	47J	0.9212
357	DX4	0.9211
358	1XN	0.9211
359	SW7	0.9210
360	DBJ	0.9210
361	1DJ	0.9209
362	JZ9	0.9209
363	AC6	0.9209
364	4AA	0.9208
365	ICO	0.9207
366	150	0.9207
367	AGK	0.9206
368	60P	0.9206
369	86J	0.9206
370	HLR	0.9205
371	HIO	0.9203
372	2LP	0.9203
373	0HO	0.9203
374	OW7	0.9202
375	XM0	0.9201
376	RIB	0.9200
377	PAC	0.9200
378	PMB	0.9200
379	HJP	0.9199
380	7WA	0.9198
381	DOB	0.9198
382	270	0.9197
383	ET2	0.9197
384	4M4	0.9196
385	FB2	0.9194
386	K5W	0.9194
387	HT4	0.9194
388	LNR	0.9193
389	ZZT	0.9193
390	3FH	0.9192
391	4HC	0.9192
392	PYC	0.9191
393	A7W	0.9190
394	EKZ	0.9188
395	0CT	0.9188
396	FBU	0.9186
397	826	0.9185
398	EUG	0.9182
399	ASP	0.9182
400	SHA	0.9181
401	42C	0.9180
402	CLW	0.9179
403	DIN	0.9179
404	GVH	0.9179
405	ZXD	0.9178
406	BCU	0.9178
407	7W4	0.9178
408	DIE	0.9177
409	F81	0.9176
410	0CU	0.9176
411	BTY	0.9176
412	JA8	0.9175
413	97T	0.9175
414	G3F	0.9175
415	BDP	0.9175
416	0F9	0.9174
417	KUF	0.9174
418	5JL	0.9172
419	ZZ3	0.9172
420	MJ2	0.9171
421	NOJ	0.9171
422	VNJ	0.9169
423	0R1	0.9169
424	FOA	0.9169
425	BHA	0.9169
426	F12	0.9169
427	J5I	0.9168
428	P3K	0.9166
429	OK7	0.9165
430	5AC	0.9164
431	DHQ	0.9164
432	8TX	0.9164
433	M1A	0.9163
434	MWM	0.9161
435	F4Z	0.9160
436	L5V	0.9159
437	FBB	0.9159
438	FBV	0.9159
439	F9P	0.9158
440	D48	0.9157
441	CWS	0.9156
442	XLS	0.9155
443	67N	0.9155
444	3NY	0.9154
445	B55	0.9154
446	G4D	0.9152
447	Q24	0.9152
448	4P5	0.9152
449	265	0.9151
450	4ZE	0.9150
451	GJZ	0.9149
452	4SX	0.9149
453	GCS	0.9149
454	2YU	0.9148
455	TPA	0.9147
456	K2T	0.9147
457	TM7	0.9144
458	3IT	0.9144
459	MCT	0.9144
460	2F6	0.9143
461	0HN	0.9142
462	BTE	0.9141
463	4M0	0.9141
464	1WG	0.9141
465	XYP	0.9141
466	5VM	0.9139
467	EDR	0.9136
468	KJU	0.9136
469	6OT	0.9135
470	SE2	0.9135
471	URF	0.9132
472	5UC	0.9132
473	0JD	0.9130
474	TC7	0.9130
475	A29	0.9128
476	3SK	0.9128
477	TH0	0.9128
478	1DV	0.9127
479	L99	0.9127
480	KT7	0.9124
481	173	0.9124
482	J9Q	0.9123
483	284	0.9123
484	FUD	0.9122
485	273	0.9121
486	ASO	0.9120
487	HH5	0.9120
488	JBH	0.9120
489	2MI	0.9119
490	6NT	0.9119
491	1DU	0.9118
492	25W	0.9118
493	DE5	0.9117
494	8S0	0.9117
495	4Z4	0.9115
496	1MR	0.9115
497	E7Z	0.9115
498	G6D	0.9114
499	HBA	0.9113
500	HYP	0.9111
501	TEO	0.9109
502	8WO	0.9109
503	0P6	0.9109
504	CRS	0.9108
505	ZBT	0.9107
506	6LW	0.9105
507	DHS	0.9104
508	4ME	0.9103
509	CXF	0.9102
510	JAE	0.9102
511	FP1	0.9102
512	P92	0.9101
513	8G0	0.9100
514	2D0	0.9100
515	5JC	0.9100
516	AZ9	0.9100
517	JZ3	0.9100
518	PEP	0.9099
519	ASN	0.9098
520	RCO	0.9098
521	DGJ	0.9095
522	OMD	0.9094
523	N2I	0.9092
524	X09	0.9092
525	ONR	0.9091
526	R20	0.9091
527	L3Q	0.9090
528	7N0	0.9089
529	MRW	0.9089
530	5GU	0.9088
531	PKU	0.9088
532	6TZ	0.9086
533	4H2	0.9086
534	463	0.9085
535	XBZ	0.9085
536	8H8	0.9085
537	MRZ	0.9084
538	0N7	0.9084
539	6VD	0.9082
540	HY1	0.9081
541	DNF	0.9081
542	MXN	0.9080
543	XUL	0.9079
544	F9Y	0.9079
545	HQD	0.9079
546	12Q	0.9079
547	FB1	0.9078
548	NOY	0.9076
549	NK	0.9075
550	G5V	0.9074
551	0R0	0.9074
552	8ZE	0.9072
553	LYL	0.9072
554	261	0.9072
555	2HU	0.9072
556	MZG	0.9071
557	DFB	0.9070
558	JZ5	0.9069
559	MWP	0.9068
560	1F1	0.9067
561	QY9	0.9066
562	1MC	0.9066
563	TDR	0.9066
564	275	0.9065
565	URQ	0.9064
566	3Z8	0.9064
567	4HO	0.9064
568	II6	0.9063
569	A1U	0.9063
570	GXY	0.9063
571	H76	0.9061
572	DTL	0.9060
573	NBE	0.9060
574	4JP	0.9060
575	M4T	0.9059
576	JAB	0.9059
577	26D	0.9058
578	HGQ	0.9057
579	HEW	0.9057
580	URA	0.9057
581	MO8	0.9056
582	LCN	0.9055
583	5NI	0.9055
584	GAL	0.9054
585	PEA	0.9054
586	BVF	0.9054
587	7WR	0.9053
588	M3T	0.9053
589	CTL	0.9052
590	0LH	0.9051
591	CN0	0.9050
592	54D	0.9050
593	HQT	0.9050
594	32X	0.9050
595	0FO	0.9050
596	263	0.9049
597	LG3	0.9049
598	G2F	0.9048
599	4WL	0.9048
600	LXC	0.9048
601	IFL	0.9047
602	M2H	0.9046
603	4XV	0.9046
604	4ZA	0.9046
605	45C	0.9044
606	PRS	0.9042
607	2ZM	0.9042
608	8CM	0.9042
609	24B	0.9042
610	TTL	0.9042
611	QWW	0.9041
612	LG5	0.9041
613	GRE	0.9036
614	3DM	0.9035
615	WBU	0.9035
616	LDP	0.9035
617	92K	0.9033
618	TSS	0.9030
619	6GU	0.9030
620	Z6J	0.9029
621	2AC	0.9029
622	HSE	0.9028
623	6NI	0.9028
624	UAN	0.9027
625	CYT	0.9027
626	CWJ	0.9026
627	2XX	0.9026
628	7W1	0.9026
629	B3R	0.9026
630	B2J	0.9025
631	2AK	0.9025
632	RNS	0.9024
633	R8A	0.9023
634	5WY	0.9023
635	52C	0.9019
636	K34	0.9019
637	IF7	0.9018
638	6F0	0.9018
639	LDU	0.9017
640	34A	0.9017
641	GV9	0.9014
642	UFV	0.9014
643	4JQ	0.9013
644	UY7	0.9012
645	9CL	0.9012
646	8K2	0.9012
647	3SL	0.9011
648	MWJ	0.9011
649	4VP	0.9010
650	XYD	0.9010
651	286	0.9009
652	SKA	0.9009
653	OHG	0.9009
654	RJY	0.9008
655	VXX	0.9008
656	4XS	0.9007
657	1SA	0.9006
658	BSX	0.9006
659	GLU	0.9006
660	RMN	0.9005
661	MQN	0.9005
662	AKG	0.9005
663	X05	0.9003
664	4JJ	0.9003
665	5MH	0.9003
666	WOT	0.9000
667	ABI	0.9000
668	2A9	0.8999
669	QX2	0.8999
670	H7Y	0.8998
671	6M1	0.8998
672	9R5	0.8997
673	DQU	0.8997
674	FUM	0.8997
675	5QX	0.8996
676	CIG	0.8996
677	43M	0.8995
678	ICP	0.8994
679	2MP	0.8993
680	94W	0.8993
681	C2Y	0.8992
682	23W	0.8992
683	AZF	0.8990
684	XHP	0.8990
685	4YO	0.8989
686	KTA	0.8988
687	PEL	0.8988
688	5WX	0.8987
689	PXL	0.8987
690	GTR	0.8986
691	J1Z	0.8986
692	B62	0.8984
693	BR9	0.8984
694	ADA	0.8983
695	3A9	0.8982
696	SR1	0.8981
697	6RQ	0.8981
698	8IG	0.8981
699	7CZ	0.8981
700	MZW	0.8980
701	BK9	0.8979
702	ODO	0.8979
703	NID	0.8978
704	B60	0.8977
705	LGC	0.8976
706	URP	0.8976
707	SPA	0.8975
708	717	0.8974
709	SIN	0.8973
710	2FY	0.8972
711	2H5	0.8972
712	0TU	0.8971
713	8GF	0.8971
714	4CL	0.8970
715	2EC	0.8969
716	KYD	0.8969
717	69O	0.8968
718	4SD	0.8968
719	FDB	0.8968
720	GUA	0.8968
721	FA1	0.8967
722	RBL	0.8962
723	GCU	0.8960
724	AS3	0.8960
725	N8Y	0.8960
726	MT0	0.8960
727	6ME	0.8959
728	27Y	0.8959
729	IUR	0.8959
730	2BG	0.8958
731	RAT	0.8957
732	3HP	0.8957
733	8OZ	0.8957
734	TWO	0.8957
735	QPR	0.8957
736	OKG	0.8956
737	LER	0.8956
738	SYV	0.8956
739	4AV	0.8955
740	RNT	0.8954
741	TLA	0.8954
742	PYJ	0.8953
743	EQT	0.8953
744	HDH	0.8951
745	GLY GLY	0.8950
746	D07	0.8949
747	NSP	0.8949
748	HSM	0.8947
749	MAQ	0.8947
750	4NM	0.8946
751	329	0.8946
752	12M	0.8944
753	AAS	0.8943
754	JAW	0.8943
755	9RW	0.8942
756	4NG	0.8942
757	MAN	0.8942
758	RAM	0.8942
759	3HG	0.8941
760	SMN	0.8941
761	Y8I	0.8941
762	OTW	0.8941
763	42J	0.8939
764	EV0	0.8939
765	APY	0.8937
766	8WT	0.8937
767	4MU	0.8936
768	1AL	0.8935
769	MZB	0.8935
770	FRU	0.8935
771	MS9	0.8934
772	HX2	0.8934
773	MNM	0.8933
774	TLD	0.8933
775	FUL	0.8933
776	TAR	0.8932
777	RHU	0.8932
778	GIO	0.8932
779	F5B	0.8931
780	OGA	0.8930
781	SRO	0.8930
782	0TR	0.8928
783	NXA	0.8927
784	82I	0.8926
785	JZ2	0.8926
786	4P0	0.8925
787	GLA	0.8925
788	TSU	0.8925
789	DMJ	0.8923
790	0GZ	0.8923
791	CTS	0.8923
792	URS	0.8921
793	R2B	0.8921
794	92P	0.8920
795	M6W	0.8918
796	AH8	0.8917
797	KBG	0.8917
798	TAG	0.8917
799	NDH	0.8916
800	44V	0.8916
801	IV2	0.8915
802	PYD	0.8914
803	15L	0.8912
804	2ZV	0.8912
805	SEP	0.8911
806	QMP	0.8911
807	XIY	0.8910
808	5XB	0.8909
809	4JO	0.8909
810	ICF	0.8908
811	HLD	0.8907
812	KDV	0.8906
813	2LY	0.8905
814	PIM	0.8904
815	G3P	0.8903
816	G3H	0.8903
817	44W	0.8903
818	XRG	0.8902
819	AEH	0.8902
820	HHQ	0.8902
821	QIC	0.8901
822	XXR	0.8900
823	495	0.8899
824	9FL	0.8899
825	Z5P	0.8898
826	FCR	0.8898
827	13P	0.8896
828	SAN	0.8896
829	O72	0.8896
830	4BZ	0.8896
831	H3M	0.8895
832	GAF	0.8893
833	SOE	0.8892
834	MVN	0.8891
835	KIV	0.8891
836	2PG	0.8890
837	XSP	0.8890
838	1GP	0.8890
839	PEQ	0.8888
840	0V5	0.8888
841	B53	0.8888
842	HQ9	0.8887
843	EXO	0.8887
844	IDH	0.8885
845	YIO	0.8884
846	LEU	0.8884
847	HXX	0.8883
848	INE	0.8883
849	FBJ	0.8882
850	EOL	0.8882
851	ALL	0.8879
852	3BU	0.8877
853	A09	0.8876
854	B24	0.8875
855	2FG	0.8874
856	9X7	0.8873
857	13X	0.8873
858	OTR	0.8871
859	SWA	0.8871
860	AJV	0.8871
861	DUC	0.8871
862	T6C	0.8871
863	5RO	0.8870
864	LKA	0.8868
865	WOO	0.8868
866	GIV	0.8867
867	TYL	0.8867
868	6UA	0.8867
869	FPY	0.8865
870	3PG	0.8864
871	N8P	0.8863
872	KJH	0.8863
873	LSA	0.8863
874	4J8	0.8860
875	TFB	0.8860
876	4FA	0.8856
877	DAS	0.8853
878	X6X	0.8852
879	PGH	0.8851
880	1GN	0.8851
881	BP9	0.8850
882	PNZ	0.8850
883	APZ	0.8850
884	LRH	0.8849
885	SC2	0.8849
886	GXL	0.8849
887	1DQ	0.8848
888	2ZQ	0.8848
889	HA7	0.8847
890	G2H	0.8846
891	JBQ	0.8846
892	HCS	0.8844
893	KJY	0.8844
894	TT4	0.8844
895	SOR	0.8843
896	ANN	0.8843
897	MBD	0.8842
898	149	0.8841
899	KDF	0.8841
900	SD4	0.8840
901	5ZE	0.8840
902	AX2	0.8840
903	JIF	0.8838
904	JXN	0.8837
905	KIB	0.8836
906	FBS	0.8835
907	DUB	0.8835
908	MAK	0.8835
909	4JL	0.8834
910	TGX	0.8833
911	HZQ	0.8833
912	PIY	0.8833
913	SHG	0.8832
914	M1Q	0.8830
915	3WA	0.8830
916	EVA	0.8828
917	JDN	0.8828
918	MBG	0.8827
919	7ZE	0.8827
920	R67	0.8826
921	RIP	0.8825
922	6MH	0.8824
923	1LM	0.8823
924	AX3	0.8823
925	GP9	0.8822
926	AHB	0.8821
927	PQ0	0.8821
928	VOH	0.8820
929	HA5	0.8819
930	GZ3	0.8818
931	GMN	0.8818
932	3AY	0.8816
933	GLY PRO	0.8815
934	293	0.8814
935	SF9	0.8814
936	7MH	0.8813
937	4TU	0.8813
938	39A	0.8811
939	XXG	0.8811
940	PYG	0.8810
941	O2A	0.8809
942	PQK	0.8808
943	MAE	0.8807
944	ERH	0.8806
945	JB8	0.8806
946	9CA	0.8806
947	B57	0.8804
948	KMH	0.8802
949	IPB	0.8802
950	OHP	0.8800
951	GLN	0.8800
952	23J	0.8799
953	15E	0.8799
954	BEA	0.8799
955	1M2	0.8798
956	M3H	0.8797
957	NCD	0.8796
958	FH2	0.8796
959	3MG	0.8794
960	IP0	0.8794
961	51F	0.8791
962	XYS	0.8790
963	BZ2	0.8789
964	FBA	0.8788
965	GCB	0.8787
966	94N	0.8787
967	ITN	0.8786
968	W81	0.8786
969	BDF	0.8785
970	9YL	0.8782
971	MRY	0.8779
972	2MY	0.8779
973	FLM	0.8779
974	MPV	0.8779
975	CEE	0.8778
976	BVC	0.8778
977	2TQ	0.8778
978	RXA	0.8778
979	TEP	0.8777
980	E35	0.8777
981	PBE	0.8776
982	BR8	0.8774
983	BMA	0.8773
984	TM4	0.8773
985	PBA	0.8773
986	HPY	0.8772
987	FDK	0.8772
988	LLQ	0.8771
989	CH9	0.8771
990	285	0.8770
991	JZ4	0.8769
992	SPV	0.8768
993	2MH	0.8768
994	DHR	0.8767
995	0W1	0.8765
996	ADK	0.8765
997	ARB	0.8764
998	OTD	0.8763
999	CIZ	0.8763
1000	NQ	0.8763
1001	H8N	0.8762
1002	1IT	0.8762
1003	HC4	0.8760
1004	NVU	0.8759
1005	AMS	0.8756
1006	GVG	0.8756
1007	271	0.8755
1008	4JU	0.8755
1009	2C9	0.8754
1010	259	0.8753
1011	3CE	0.8753
1012	YSO	0.8753
1013	JZ1	0.8752
1014	2FQ	0.8752
1015	152	0.8751
1016	2ZX	0.8751
1017	2AS	0.8749
1018	TCZ	0.8749
1019	3FA	0.8749
1020	TTY	0.8748
1021	FUC	0.8747
1022	0MK	0.8746
1023	15N	0.8745
1024	DGN	0.8744
1025	FA3	0.8742
1026	FW5	0.8741
1027	FBT	0.8741
1028	2CM	0.8740
1029	5AN	0.8740
1030	TOF	0.8739
1031	DFU	0.8736
1032	VK3	0.8736
1033	NCT	0.8735
1034	TBP	0.8735
1035	PYQ	0.8735
1036	HVQ	0.8734
1037	AJY	0.8734
1038	AHN	0.8733
1039	4JM	0.8733
1040	RD4	0.8732
1041	DNC	0.8732
1042	SXS	0.8732
1043	PRY	0.8731
1044	M4E	0.8730
1045	ZB1	0.8729
1046	3MC	0.8729
1047	MZ0	0.8729
1048	CRN	0.8727
1049	AEF	0.8727
1050	WDL	0.8726
1051	7B3	0.8726
1052	S2G	0.8725
1053	SF6	0.8721
1054	PEY	0.8721
1055	280	0.8718
1056	JFD	0.8717
1057	GOO	0.8716
1058	APG	0.8715
1059	FPK	0.8714
1060	3QM	0.8711
1061	5CL	0.8710
1062	CXL	0.8710
1063	IHG	0.8709
1064	DTU	0.8707
1065	40O	0.8707
1066	4VY	0.8706
1067	9FE	0.8705
1068	J6W	0.8702
1069	64K	0.8701
1070	2HG	0.8699
1071	E5X	0.8699
1072	ECE	0.8697
1073	NVI	0.8697
1074	T2C	0.8697
1075	KIA	0.8696
1076	N3W	0.8695
1077	H4E	0.8694
1078	PRF	0.8693
1079	NLE	0.8691
1080	CFF	0.8691
1081	M1Z	0.8690
1082	1U6	0.8690
1083	BNF	0.8689
1084	M45	0.8689
1085	3MH	0.8689
1086	PEZ	0.8688
1087	ZZ8	0.8687
1088	091	0.8687
1089	ESI	0.8685
1090	PFL	0.8685
1091	PLQ	0.8683
1092	JXW	0.8682
1093	FFP	0.8681
1094	E1T	0.8679
1095	8XL	0.8677
1096	6FZ	0.8675
1097	2FT	0.8673
1098	DHY	0.8671
1099	MAJ	0.8666
1100	C2B	0.8666
1101	YRL	0.8664
1102	PCR	0.8664
1103	XDE	0.8663
1104	MET	0.8663
1105	39O	0.8663
1106	6R8	0.8661
1107	JUG	0.8661
1108	H62	0.8660
1109	HQE	0.8660
1110	1LN	0.8658
1111	YHO	0.8658
1112	IPZ	0.8656
1113	FPN	0.8656
1114	5NE	0.8654
1115	AY4	0.8652
1116	PHE	0.8650
1117	KFH	0.8650
1118	UEG	0.8648
1119	PHH	0.8648
1120	K17	0.8646
1121	R8V	0.8646
1122	LG4	0.8644
1123	SYA	0.8641
1124	3MA	0.8640
1125	4V2	0.8637
1126	HPS	0.8636
1127	0OC	0.8635
1128	TBS	0.8635
1129	DA1	0.8631
1130	SIF	0.8630
1131	E60	0.8628
1132	Q7A	0.8627
1133	HAI	0.8625
1134	RM4	0.8624
1135	CIT	0.8623
1136	G1O	0.8623
1137	FCA	0.8623
1138	PGA	0.8619
1139	9TY	0.8619
1140	PXY	0.8619
1141	ARA	0.8618
1142	BVG	0.8617
1143	M44	0.8614
1144	2HC	0.8612
1145	PHT	0.8612
1146	SWD	0.8611
1147	VAL	0.8610
1148	N2Z	0.8608
1149	NDM	0.8608
1150	INS	0.8608
1151	Q71	0.8607
1152	CYH	0.8606
1153	9ZE	0.8605
1154	4A5	0.8605
1155	ICC	0.8602
1156	GXE	0.8598
1157	95Z	0.8595
1158	FLC	0.8594
1159	JG8	0.8594
1160	EN1	0.8593
1161	IWT	0.8592
1162	EMZ	0.8590
1163	DEE	0.8590
1164	IAC	0.8588
1165	KYA	0.8587
1166	XEN	0.8586
1167	R9Y	0.8585
1168	I6G	0.8583
1169	PSV	0.8579
1170	DGL	0.8578
1171	KDG	0.8578
1172	BPN	0.8578
1173	ICB	0.8574
1174	7VJ	0.8571
1175	QX4	0.8570
1176	278	0.8565
1177	12B	0.8563
1178	CPZ	0.8563
1179	CLZ	0.8562
1180	JND	0.8562
1181	1XX	0.8562
1182	NTM	0.8561
1183	PXM	0.8557
1184	1X7	0.8555
1185	NEQ	0.8551
1186	1KP	0.8550
1187	X1R	0.8539
1188	GJS	0.8531
1189	8CL	0.8525
1190	Q02	0.8518
1191	THR	0.8510
1192	F4E	0.8510

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

Pocket No.: 1; Query (leader) PDB : 3CW9; Ligand: 01A; 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: 3cw9.bio1) has 29 residues
No:	Leader PDB	Ligand	Sequence Similarity

Pocket No.: 2; Query (leader) PDB : 3CW9; Ligand: AMP; Similar sites found with APoc: 4

This union binding pocket(no: 2) in the query (biounit: 3cw9.bio1) has 20 residues
No:	Leader PDB	Ligand	Sequence Similarity
1	1AMU	AMP	42.8571
2	5N9X	8QN	44.8413
3	5X8G	S0N	49.2784
4	5X8G	S0N	49.2784

Pocket No.: 3; Query (leader) PDB : 3CW9; Ligand: AMP; Similar sites found with APoc: 7

This union binding pocket(no: 3) in the query (biounit: 3cw9.bio1) has 20 residues
No:	Leader PDB	Ligand	Sequence Similarity
1	6OZ1	AMP	35.7143
2	1V25	ANP	41.6667
3	1AMU	AMP	42.8571
4	5N9X	8QN	44.8413
5	5N9X	ATP	44.8413
6	5X8G	S0N	49.2784
7	5X8G	S0N	49.2784

Pocket No.: 4; Query (leader) PDB : 3CW9; Ligand: 01A; 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: 3cw9.bio1) has 29 residues
No:	Leader PDB	Ligand	Sequence Similarity

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