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Showing PDB: 1JHM

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Receptor | Ligand | View in 3D

Family: 90% | 70% | 50% | site

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      Structure Biounit | Ligand Information

PDB           : .ZIP | .CSV

Family 90% : .ZIP | .CSV

Class         : .ZIP | .CSV

Receptor

PDB id	Resolution	Class	Description	Source	Keywords
1JHM	2.2 Å	EC: 2.4.2.21	THREE-DIMENSIONAL STRUCTURE OF COBT IN COMPLEX WITH 5- METHYLBENZIMIDAZOLE	SALMONELLA ENTERICA	COBT COBALAMIN BIOSYNTHESIS LOWER LIGAND COBAMIDES NN:DBN1-ALPHA-PHOSPHORIBOSYLTRANSFERASE TRANSFERASE
Ref.:	STRUCTURAL INVESTIGATION OF THE BIOSYNTHESIS OF ALT LOWER LIGANDS FOR COBAMIDES BY NICOTINATE MONONUCLE 5,6-DIMETHYLBENZIMIDAZOLE PHOSPHORIBOSYLTRANSFERASE SALMONELLA ENTERICA. J.BIOL.CHEM. V. 276 37612 2001

Ligand

Ligand	Chain:Residue	Validity	Ligand Warnings	Binding Data	NGL Viewer	Molecular Weight (Da)	Formula	SMILES
5MB	A:990;	Valid;	none;	submit data		132.163	C8 H8 N2	Cc1cc...
PO4	A:991; A:992;	Invalid; Invalid;	none; none;	submit data		94.971	O4 P	[O-]P...

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90% Homology Family

Leader

PDB id	Resolution	Class	Description	Source	Keywords
4KQI	1.4 Å	EC: 2.4.2.21	CRYSTAL STRUCTURE OF COBT E317A COMPLEXED WITH ITS REACTION	SALMONELLA ENTERICA SUBSP. ENTERICA SETYPHIMURIUM	TRANSFERASE
Ref.:	DISSECTING COBAMIDE DIVERSITY THROUGH STRUCTURAL AN FUNCTIONAL ANALYSES OF THE BASE-ACTIVATING COBT ENZ SALMONELLA ENTERICA. BIOCHIM.BIOPHYS.ACTA V.1840 464 2014

Members (31)

No:	PDB id	Binding Data	Representative ligand	Formula	Smiles
The Class containing this family consists of a total of 2 families.
1	1L4G	-	NCN	C11 H14 N O9 P	c1cc(c[n+]....
2	1D0S	-	DMD	C9 H10 N2	Cc1cc2c(cc....
3	1L4K	-	NCN	C11 H14 N O9 P	c1cc(c[n+]....
4	4KQF	-	ADE	C5 H5 N5	c1[nH]c2c(....
5	4KQJ	-	PCR	C7 H8 O	Cc1ccc(cc1....
6	1L4F	-	NCN	C11 H14 N O9 P	c1cc(c[n+]....
7	1JHV	-	PCR	C7 H8 O	Cc1ccc(cc1....
8	4KQG	-	DMD	C9 H10 N2	Cc1cc2c(cc....
9	1L4N	-	NIO	C6 H5 N O2	c1cc(cnc1)....
10	1JHM	-	5MB	C8 H8 N2	Cc1ccc2c(c....
11	1JHU	-	PCR	C7 H8 O	Cc1ccc(cc1....
12	1JH8	-	ADE	C5 H5 N5	c1[nH]c2c(....
13	1L4M	-	NCN	C11 H14 N O9 P	c1cc(c[n+]....
14	1L5L	-	NIO	C6 H5 N O2	c1cc(cnc1)....
15	1L4L	-	XYD	C8 H11 N	Cc1ccc(c(c....
16	1JHQ	-	PMO	C13 H17 N2 O8 P	COc1ccc2c(....
17	1L5K	-	NIO	C6 H5 N O2	c1cc(cnc1)....
18	1JHP	-	5OB	C8 H8 N2 O	COc1ccc2c(....
19	1JHY	-	NIO	C6 H5 N O2	c1cc(cnc1)....
20	1L5M	-	NIO	C6 H5 N O2	c1cc(cnc1)....
21	1JHA	-	NIO	C6 H5 N O2	c1cc(cnc1)....
22	1JHX	-	IPH	C6 H6 O	c1ccc(cc1)....
23	1JHO	-	RMB	C13 H17 N2 O7 P	Cc1ccc2c(c....
24	1JHR	-	P2P	C10 H13 N4 O8 P	c1c2c(ncn2....
25	1L4E	-	RBZ	C14 H19 N2 O7 P	Cc1cc2c(cc....
26	4KQK	-	PCR	C7 H8 O	Cc1ccc(cc1....
27	1D0V	-	RBZ	C14 H19 N2 O7 P	Cc1cc2c(cc....
28	1L5O	-	NCN	C11 H14 N O9 P	c1cc(c[n+]....
29	1L5F	-	BZI	C7 H6 N2	c1ccc2c(c1....
30	1L4H	-	NCN	C11 H14 N O9 P	c1cc(c[n+]....
31	4KQI	-	NIO	C6 H5 N O2	c1cc(cnc1)....

70% Homology Family (31)

No:	PDB id	Binding Data	Representative ligand	Formula	Smiles
The Class containing this family consists of a total of 2 families.
1	1L4G	-	NCN	C11 H14 N O9 P	c1cc(c[n+]....
2	1D0S	-	DMD	C9 H10 N2	Cc1cc2c(cc....
3	1L4K	-	NCN	C11 H14 N O9 P	c1cc(c[n+]....
4	4KQF	-	ADE	C5 H5 N5	c1[nH]c2c(....
5	4KQJ	-	PCR	C7 H8 O	Cc1ccc(cc1....
6	1L4F	-	NCN	C11 H14 N O9 P	c1cc(c[n+]....
7	1JHV	-	PCR	C7 H8 O	Cc1ccc(cc1....
8	4KQG	-	DMD	C9 H10 N2	Cc1cc2c(cc....
9	1L4N	-	NIO	C6 H5 N O2	c1cc(cnc1)....
10	1JHM	-	5MB	C8 H8 N2	Cc1ccc2c(c....
11	1JHU	-	PCR	C7 H8 O	Cc1ccc(cc1....
12	1JH8	-	ADE	C5 H5 N5	c1[nH]c2c(....
13	1L4M	-	NCN	C11 H14 N O9 P	c1cc(c[n+]....
14	1L5L	-	NIO	C6 H5 N O2	c1cc(cnc1)....
15	1L4L	-	XYD	C8 H11 N	Cc1ccc(c(c....
16	1JHQ	-	PMO	C13 H17 N2 O8 P	COc1ccc2c(....
17	1L5K	-	NIO	C6 H5 N O2	c1cc(cnc1)....
18	1JHP	-	5OB	C8 H8 N2 O	COc1ccc2c(....
19	1JHY	-	NIO	C6 H5 N O2	c1cc(cnc1)....
20	1L5M	-	NIO	C6 H5 N O2	c1cc(cnc1)....
21	1JHA	-	NIO	C6 H5 N O2	c1cc(cnc1)....
22	1JHX	-	IPH	C6 H6 O	c1ccc(cc1)....
23	1JHO	-	RMB	C13 H17 N2 O7 P	Cc1ccc2c(c....
24	1JHR	-	P2P	C10 H13 N4 O8 P	c1c2c(ncn2....
25	1L4E	-	RBZ	C14 H19 N2 O7 P	Cc1cc2c(cc....
26	4KQK	-	PCR	C7 H8 O	Cc1ccc(cc1....
27	1D0V	-	RBZ	C14 H19 N2 O7 P	Cc1cc2c(cc....
28	1L5O	-	NCN	C11 H14 N O9 P	c1cc(c[n+]....
29	1L5F	-	BZI	C7 H6 N2	c1ccc2c(c1....
30	1L4H	-	NCN	C11 H14 N O9 P	c1cc(c[n+]....
31	4KQI	-	NIO	C6 H5 N O2	c1cc(cnc1)....

50% Homology Family (31)

No:	PDB id	Binding Data	Representative ligand	Formula	Smiles
The Class containing this family consists of a total of 5 families.
1	1L4G	-	NCN	C11 H14 N O9 P	c1cc(c[n+]....
2	1D0S	-	DMD	C9 H10 N2	Cc1cc2c(cc....
3	1L4K	-	NCN	C11 H14 N O9 P	c1cc(c[n+]....
4	4KQF	-	ADE	C5 H5 N5	c1[nH]c2c(....
5	4KQJ	-	PCR	C7 H8 O	Cc1ccc(cc1....
6	1L4F	-	NCN	C11 H14 N O9 P	c1cc(c[n+]....
7	1JHV	-	PCR	C7 H8 O	Cc1ccc(cc1....
8	4KQG	-	DMD	C9 H10 N2	Cc1cc2c(cc....
9	1L4N	-	NIO	C6 H5 N O2	c1cc(cnc1)....
10	1JHM	-	5MB	C8 H8 N2	Cc1ccc2c(c....
11	1JHU	-	PCR	C7 H8 O	Cc1ccc(cc1....
12	1JH8	-	ADE	C5 H5 N5	c1[nH]c2c(....
13	1L4M	-	NCN	C11 H14 N O9 P	c1cc(c[n+]....
14	1L5L	-	NIO	C6 H5 N O2	c1cc(cnc1)....
15	1L4L	-	XYD	C8 H11 N	Cc1ccc(c(c....
16	1JHQ	-	PMO	C13 H17 N2 O8 P	COc1ccc2c(....
17	1L5K	-	NIO	C6 H5 N O2	c1cc(cnc1)....
18	1JHP	-	5OB	C8 H8 N2 O	COc1ccc2c(....
19	1JHY	-	NIO	C6 H5 N O2	c1cc(cnc1)....
20	1L5M	-	NIO	C6 H5 N O2	c1cc(cnc1)....
21	1JHA	-	NIO	C6 H5 N O2	c1cc(cnc1)....
22	1JHX	-	IPH	C6 H6 O	c1ccc(cc1)....
23	1JHO	-	RMB	C13 H17 N2 O7 P	Cc1ccc2c(c....
24	1JHR	-	P2P	C10 H13 N4 O8 P	c1c2c(ncn2....
25	1L4E	-	RBZ	C14 H19 N2 O7 P	Cc1cc2c(cc....
26	4KQK	-	PCR	C7 H8 O	Cc1ccc(cc1....
27	1D0V	-	RBZ	C14 H19 N2 O7 P	Cc1cc2c(cc....
28	1L5O	-	NCN	C11 H14 N O9 P	c1cc(c[n+]....
29	1L5F	-	BZI	C7 H6 N2	c1ccc2c(c1....
30	1L4H	-	NCN	C11 H14 N O9 P	c1cc(c[n+]....
31	4KQI	-	NIO	C6 H5 N O2	c1cc(cnc1)....

Polypharmacology

Similar Ligands (2D)

Ligand no: 1; Ligand: 5MB; Similar ligands found: 5

No:	Ligand	ECFP6 Tc	MDL keys Tc
1	5MB	1	1
2	5OB	0.534884	0.714286
3	ABI	0.4375	0.655172
4	DMD	0.409091	0.869565
5	BZI	0.404762	0.95

Similar Ligands (3D)

Ligand no: 1; Ligand: 5MB; Similar ligands found: 1244

No:	Ligand	Similarity coefficient
1	14O	1.0000
2	5H1	1.0000
3	ES9	1.0000
4	F60	1.0000
5	5MI	1.0000
6	2K4	1.0000
7	6AI	1.0000
8	BZX	1.0000
9	11S	0.9991
10	H4N	0.9969
11	FK1	0.9965
12	8NY	0.9894
13	H42	0.9845
14	4FS	0.9835
15	COU	0.9830
16	JB5	0.9821
17	03V	0.9805
18	2AQ	0.9792
19	ES5	0.9788
20	NPO	0.9783
21	VGD	0.9777
22	OCH	0.9769
23	BZ3	0.9768
24	ET2	0.9756
25	ABV	0.9742
26	MR1	0.9735
27	RM1	0.9733
28	36R	0.9731
29	1P7	0.9730
30	9DG	0.9726
31	GUN	0.9716
32	6M9	0.9714
33	XQ0	0.9714
34	6GU	0.9711
35	5WV	0.9709
36	DEN	0.9709
37	5XC	0.9707
38	0CT	0.9707
39	CLW	0.9704
40	QUZ	0.9704
41	AZG	0.9702
42	ES2	0.9700
43	1P8	0.9699
44	AZA	0.9699
45	AHR	0.9699
46	A2F	0.9698
47	6AP	0.9697
48	0RW	0.9693
49	XAN	0.9686
50	AX7	0.9686
51	IND	0.9684
52	OAA	0.9683
53	8GC	0.9681
54	NPY	0.9680
55	5B1	0.9679
56	9EW	0.9679
57	RSF	0.9679
58	BZF	0.9676
59	5VM	0.9672
60	1XM	0.9670
61	PHB	0.9670
62	ISN	0.9669
63	F05	0.9668
64	LZ1	0.9667
65	1PT	0.9667
66	XYP	0.9667
67	7W4	0.9663
68	M1A	0.9662
69	67N	0.9661
70	4JP	0.9661
71	DX4	0.9659
72	0R1	0.9659
73	F9Y	0.9655
74	TH7	0.9655
75	141	0.9655
76	0CU	0.9647
77	IGA	0.9645
78	LXC	0.9644
79	GVH	0.9643
80	YH7	0.9638
81	270	0.9636
82	MPI	0.9636
83	YCP	0.9636
84	6M4	0.9634
85	BEZ	0.9634
86	3ID	0.9630
87	I3A	0.9630
88	GLC	0.9629
89	7HQ	0.9625
90	BOA	0.9623
91	2MI	0.9616
92	ES7	0.9614
93	1DW	0.9613
94	SAL	0.9613
95	HMH	0.9610
96	MCT	0.9607
97	PAB	0.9607
98	SVN	0.9601
99	HH5	0.9600
100	BEN	0.9598
101	KKN	0.9597
102	6PC	0.9595
103	BAM	0.9594
104	FYU	0.9592
105	4JT	0.9590
106	K2T	0.9585
107	NOJ	0.9584
108	TH0	0.9582
109	4CS	0.9582
110	IDM	0.9578
111	QWN	0.9577
112	AZ8	0.9575
113	NCA	0.9575
114	BCP	0.9570
115	4SV	0.9570
116	HBD	0.9570
117	2CK	0.9569
118	3HB	0.9569
119	CFP	0.9565
120	8H8	0.9564
121	4HO	0.9563
122	3F0	0.9562
123	GAB	0.9562
124	NBZ	0.9561
125	2HQ	0.9558
126	FBB	0.9558
127	LZM	0.9556
128	ISZ	0.9554
129	BGC	0.9554
130	QXW	0.9552
131	290	0.9551
132	3NT	0.9551
133	1Y6	0.9551
134	NTN	0.9550
135	42A	0.9549
136	5RG	0.9548
137	3AB	0.9543
138	HBA	0.9543
139	NIO	0.9542
140	URF	0.9536
141	14J	0.9532
142	717	0.9532
143	TDR	0.9531
144	5HN	0.9529
145	MZG	0.9529
146	5NU	0.9526
147	NMJ	0.9523
148	HLR	0.9522
149	5CU	0.9521
150	MEW	0.9520
151	XM0	0.9520
152	5JC	0.9518
153	BE2	0.9517
154	MLT	0.9517
155	5UC	0.9514
156	AC0	0.9514
157	3HA	0.9513
158	NK	0.9510
159	4M0	0.9509
160	KOJ	0.9509
161	2BG	0.9508
162	5JQ	0.9508
163	JA8	0.9507
164	PE0	0.9506
165	WBU	0.9505
166	BHO	0.9504
167	1MC	0.9502
168	Z82	0.9501
169	MWM	0.9499
170	DBH	0.9498
171	4XR	0.9497
172	FA0	0.9496
173	OVV	0.9492
174	3M0	0.9491
175	URC	0.9491
176	JZ9	0.9490
177	WCE	0.9490
178	173	0.9490
179	SYV	0.9489
180	JBK	0.9488
181	PZA	0.9488
182	4CL	0.9488
183	27Y	0.9488
184	8ZE	0.9484
185	53C	0.9482
186	MWJ	0.9481
187	FQI	0.9480
188	3PF	0.9480
189	KUF	0.9479
190	3U4	0.9478
191	Q88	0.9478
192	ES6	0.9476
193	Q24	0.9474
194	86J	0.9473
195	174	0.9473
196	HMU	0.9472
197	0R0	0.9469
198	4JJ	0.9466
199	PBC	0.9466
200	VGL	0.9464
201	4ZE	0.9464
202	HPA	0.9461
203	XIY	0.9461
204	P92	0.9460
205	4HC	0.9459
206	54D	0.9458
207	GTQ	0.9458
208	XBT	0.9458
209	4JU	0.9458
210	EA1	0.9457
211	FE DB1	0.9457
212	CWS	0.9456
213	XBZ	0.9456
214	5MH	0.9456
215	5QY	0.9456
216	DOB	0.9455
217	BR9	0.9453
218	3BZ	0.9452
219	TTL	0.9451
220	NIZ	0.9450
221	I1E	0.9450
222	KJH	0.9450
223	2CQ	0.9449
224	7B4	0.9449
225	UNU	0.9446
226	PBZ	0.9446
227	NSP	0.9446
228	ADE	0.9446
229	FDB	0.9446
230	24B	0.9446
231	4VP	0.9444
232	M5K	0.9443
233	JZ3	0.9440
234	AJ2	0.9439
235	5QX	0.9438
236	G3E	0.9436
237	HQT	0.9436
238	AQO	0.9434
239	5Q0	0.9434
240	12Q	0.9434
241	BRT	0.9433
242	BTY	0.9431
243	4MA	0.9431
244	5IQ	0.9428
245	XAZ	0.9428
246	BHA	0.9427
247	SS1	0.9427
248	CWM	0.9426
249	CTL	0.9426
250	4HM	0.9426
251	7W1	0.9423
252	G3F	0.9422
253	B55	0.9421
254	1SQ	0.9419
255	XQG	0.9418
256	CFI	0.9418
257	4YS	0.9417
258	1WG	0.9416
259	5SG	0.9415
260	0P6	0.9414
261	P72	0.9412
262	1M2	0.9410
263	N5J	0.9410
264	2EC	0.9410
265	6CS	0.9409
266	A7W	0.9406
267	ES0	0.9405
268	6MP	0.9405
269	826	0.9404
270	2AC	0.9404
271	1NP	0.9404
272	1LQ	0.9403
273	10L	0.9402
274	2YU	0.9402
275	PXL	0.9402
276	SKA	0.9401
277	DHB	0.9399
278	JKE	0.9396
279	6NT	0.9396
280	KJU	0.9395
281	BE7	0.9394
282	75K	0.9394
283	9MG	0.9394
284	E5X	0.9393
285	ADZ	0.9391
286	54G	0.9390
287	150	0.9388
288	A1U	0.9387
289	ICP	0.9385
290	SW7	0.9384
291	PRO	0.9383
292	23A	0.9382
293	HQY	0.9381
294	2MH	0.9381
295	ZZT	0.9380
296	3OC	0.9379
297	D48	0.9378
298	4ZC	0.9378
299	GCS	0.9376
300	IUR	0.9375
301	CRS	0.9374
302	ES1	0.9373
303	JPZ	0.9373
304	B53	0.9373
305	LG4	0.9373
306	JZ2	0.9372
307	0JD	0.9371
308	O72	0.9369
309	3NY	0.9369
310	8TX	0.9368
311	8CM	0.9367
312	J1Z	0.9367
313	5M0	0.9366
314	ES4	0.9364
315	7CZ	0.9364
316	UGC	0.9363
317	9DA	0.9363
318	4JO	0.9363
319	9HX	0.9362
320	MRW	0.9361
321	XYD	0.9360
322	5JL	0.9360
323	PLQ	0.9359
324	HT4	0.9358
325	N2I	0.9358
326	MQN	0.9357
327	24W	0.9357
328	OXQ	0.9357
329	5RN	0.9357
330	TP5	0.9357
331	HQE	0.9356
332	275	0.9355
333	2ZM	0.9355
334	FAN	0.9354
335	PM6	0.9353
336	XYS	0.9353
337	TPA	0.9352
338	43M	0.9351
339	4P5	0.9351
340	82I	0.9350
341	QOS	0.9349
342	BSX	0.9348
343	HIS	0.9346
344	J5I	0.9345
345	ZBT	0.9345
346	G6D	0.9344
347	BP1	0.9342
348	FOA	0.9341
349	HHA	0.9340
350	45C	0.9340
351	PYD	0.9339
352	4NC	0.9339
353	34A	0.9338
354	4JQ	0.9338
355	IDH	0.9338
356	4XH	0.9337
357	CWJ	0.9336
358	0TR	0.9335
359	2MP	0.9334
360	0TU	0.9334
361	PCR	0.9334
362	M58	0.9333
363	7HP	0.9333
364	SX1	0.9332
365	PNZ	0.9332
366	DA1	0.9331
367	1WD	0.9330
368	DIN	0.9330
369	TM7	0.9330
370	FP1	0.9330
371	URP	0.9330
372	SE2	0.9329
373	HY3	0.9329
374	1DU	0.9328
375	RCO	0.9326
376	5MK	0.9324
377	INO	0.9324
378	GBD	0.9322
379	KDV	0.9321
380	60P	0.9320
381	6RQ	0.9319
382	8S0	0.9319
383	7WV	0.9318
384	BTE	0.9317
385	25W	0.9316
386	P9P	0.9314
387	3XX	0.9313
388	FPY	0.9313
389	4HS	0.9313
390	3MB	0.9311
391	H8N	0.9311
392	OK7	0.9310
393	2HU	0.9310
394	261	0.9309
395	FPN	0.9309
396	IT2	0.9309
397	OVM	0.9308
398	PXY	0.9308
399	3DM	0.9307
400	JLZ	0.9307
401	25R	0.9307
402	4YO	0.9305
403	7WA	0.9304
404	6NI	0.9304
405	AMC	0.9304
406	GAG	0.9303
407	PY7	0.9303
408	51R	0.9302
409	DYA	0.9300
410	2PC	0.9300
411	2D0	0.9298
412	LT2	0.9298
413	0HN	0.9297
414	NNO	0.9297
415	F81	0.9296
416	5GU	0.9296
417	3CH	0.9296
418	JAE	0.9295
419	FBM	0.9294
420	5NI	0.9294
421	PCA	0.9292
422	SYN	0.9292
423	282	0.9292
424	JBH	0.9291
425	HH8	0.9291
426	ASO	0.9290
427	QX2	0.9290
428	XX2	0.9289
429	1DV	0.9289
430	0HO	0.9289
431	IFL	0.9288
432	1F1	0.9287
433	PYC	0.9287
434	PZI	0.9286
435	284	0.9285
436	PEA	0.9283
437	P3K	0.9282
438	1P3	0.9282
439	B57	0.9280
440	QSC	0.9280
441	LMR	0.9280
442	JAW	0.9279
443	RSO	0.9279
444	AC6	0.9278
445	URA	0.9278
446	Y8I	0.9273
447	TIU	0.9273
448	8IG	0.9272
449	PKU	0.9270
450	3SK	0.9270
451	3Z8	0.9267
452	HBX	0.9266
453	4A3	0.9263
454	VNJ	0.9263
455	4JM	0.9262
456	C21	0.9261
457	9TZ	0.9260
458	3Z7	0.9260
459	JBE	0.9259
460	F4Z	0.9259
461	CYT	0.9259
462	HGQ	0.9259
463	F9P	0.9259
464	MYJ	0.9258
465	BML	0.9258
466	EQT	0.9257
467	LG3	0.9257
468	SOE	0.9257
469	5AC	0.9256
470	ABN	0.9256
471	TSS	0.9256
472	DHR	0.9255
473	4AA	0.9253
474	SWD	0.9253
475	FUL	0.9253
476	ICO	0.9251
477	94W	0.9250
478	3A9	0.9249
479	RHU	0.9249
480	BVF	0.9249
481	IV2	0.9247
482	OW4	0.9247
483	FPI	0.9247
484	SHA	0.9243
485	3HM	0.9242
486	ANN	0.9241
487	EUG	0.9239
488	1LM	0.9238
489	FBA	0.9237
490	286	0.9235
491	7VS	0.9229
492	RIP	0.9229
493	J9Q	0.9229
494	PYG	0.9228
495	4BZ	0.9227
496	E7Z	0.9223
497	LG5	0.9223
498	B3R	0.9223
499	4FA	0.9223
500	FHB	0.9222
501	4JN	0.9222
502	4CH	0.9220
503	HEW	0.9219
504	K34	0.9218
505	GAL	0.9217
506	8OZ	0.9216
507	TC7	0.9215
508	2HO	0.9214
509	KT7	0.9213
510	93K	0.9212
511	HX3	0.9212
512	NDH	0.9210
513	PYF	0.9210
514	BCU	0.9207
515	MWP	0.9205
516	GRE	0.9205
517	R8V	0.9205
518	TZC	0.9204
519	7MU	0.9202
520	DBX	0.9202
521	0MK	0.9202
522	L3Q	0.9201
523	PHU	0.9200
524	C2B	0.9199
525	6M1	0.9198
526	ARB	0.9197
527	QWW	0.9196
528	TSU	0.9196
529	MUA	0.9195
530	26D	0.9194
531	G2F	0.9194
532	265	0.9192
533	AZ9	0.9192
534	9R5	0.9191
535	BPN	0.9191
536	2ZV	0.9190
537	8WO	0.9190
538	DFB	0.9190
539	2LP	0.9189
540	M0Q	0.9186
541	0W8	0.9184
542	7NI	0.9183
543	M3T	0.9183
544	AKG	0.9183
545	B62	0.9182
546	CHB	0.9181
547	1XN	0.9181
548	WOT	0.9180
549	FCR	0.9180
550	4JL	0.9180
551	273	0.9179
552	8WT	0.9177
553	IOL	0.9175
554	DTL	0.9175
555	4WL	0.9173
556	J9T	0.9172
557	TLD	0.9172
558	3DO	0.9172
559	DRL	0.9171
560	HHQ	0.9171
561	2A9	0.9170
562	JBN	0.9170
563	GYE	0.9170
564	HDH	0.9168
565	YRL	0.9168
566	FUC	0.9165
567	6F0	0.9163
568	3ZQ	0.9162
569	AEF	0.9161
570	J9W	0.9159
571	32X	0.9159
572	G5V	0.9155
573	4H2	0.9153
574	F0J	0.9152
575	3FH	0.9152
576	XHP	0.9146
577	DFU	0.9146
578	ODO	0.9145
579	C2A	0.9144
580	ASP	0.9144
581	CIG	0.9143
582	QBK	0.9143
583	3FA	0.9143
584	MAE	0.9142
585	SRT	0.9141
586	R9S	0.9141
587	JDN	0.9140
588	DGJ	0.9139
589	MBD	0.9139
590	XRG	0.9138
591	MNM	0.9137
592	9TW	0.9134
593	AGK	0.9134
594	JIF	0.9133
595	PBA	0.9130
596	SMV	0.9130
597	JBQ	0.9129
598	DE5	0.9127
599	HLZ	0.9127
600	0FO	0.9126
601	7WG	0.9125
602	V55	0.9124
603	97T	0.9124
604	T6C	0.9124
605	UNC	0.9123
606	SAN	0.9123
607	N8Y	0.9120
608	M2K	0.9118
609	NOY	0.9115
610	EKZ	0.9114
611	CAQ	0.9113
612	8GF	0.9112
613	OHG	0.9112
614	M1Q	0.9112
615	RIB	0.9111
616	NQ	0.9110
617	3CE	0.9110
618	Q6T	0.9109
619	DHQ	0.9109
620	44W	0.9108
621	9FL	0.9108
622	GIF	0.9108
623	TLA	0.9105
624	92K	0.9104
625	QSB	0.9104
626	2CH	0.9104
627	F5B	0.9102
628	DUC	0.9102
629	UY7	0.9101
630	IPB	0.9100
631	TGX	0.9100
632	3WA	0.9099
633	6MH	0.9099
634	2C9	0.9098
635	OVP	0.9097
636	JZ1	0.9097
637	XUL	0.9095
638	4M4	0.9095
639	4ZA	0.9094
640	GLA	0.9094
641	OTR	0.9093
642	JAB	0.9092
643	6VD	0.9090
644	RMN	0.9090
645	2DR	0.9088
646	IFM	0.9085
647	BDP	0.9085
648	15E	0.9084
649	FBV	0.9083
650	TEO	0.9083
651	ECE	0.9083
652	OTW	0.9082
653	5RO	0.9082
654	DQU	0.9081
655	42C	0.9080
656	OXE	0.9080
657	R9Y	0.9080
658	LGC	0.9079
659	MO8	0.9077
660	KJY	0.9076
661	GMN	0.9074
662	TFB	0.9074
663	2AK	0.9073
664	OXC	0.9073
665	3MC	0.9072
666	2CM	0.9072
667	2H5	0.9072
668	AJV	0.9071
669	MS9	0.9070
670	1MR	0.9070
671	35C	0.9067
672	H76	0.9067
673	15N	0.9066
674	5WX	0.9066
675	RAM	0.9066
676	2AL	0.9065
677	XXR	0.9065
678	IFP	0.9064
679	23W	0.9064
680	M6N	0.9064
681	RXA	0.9064
682	DIE	0.9064
683	MAK	0.9062
684	BEW	0.9060
685	AAS	0.9059
686	6X8	0.9059
687	SJ5	0.9058
688	4Z4	0.9058
689	KYD	0.9058
690	CTS	0.9057
691	FLM	0.9057
692	VK3	0.9055
693	ABE	0.9055
694	BEA	0.9055
695	40O	0.9055
696	HSM	0.9053
697	VNL	0.9052
698	GIO	0.9052
699	259	0.9051
700	GXY	0.9051
701	TEP	0.9051
702	7N0	0.9051
703	HA5	0.9051
704	IHB	0.9050
705	HQD	0.9050
706	GCU	0.9050
707	MXN	0.9048
708	FB2	0.9048
709	FBW	0.9047
710	FFP	0.9045
711	3RK	0.9044
712	DMG	0.9044
713	37T	0.9043
714	NBE	0.9042
715	RB5	0.9041
716	ORO	0.9041
717	TMZ	0.9040
718	HY1	0.9039
719	LDP	0.9039
720	2MY	0.9037
721	FB1	0.9037
722	1AN	0.9036
723	B60	0.9034
724	AZF	0.9034
725	L89	0.9033
726	M6W	0.9029
727	MNN	0.9029
728	69O	0.9028
729	PZM	0.9028
730	938	0.9028
731	LDU	0.9027
732	HSO	0.9026
733	PDC	0.9026
734	F31	0.9025
735	1DJ	0.9023
736	7MH	0.9023
737	4NM	0.9022
738	IF7	0.9021
739	PRZ	0.9019
740	UAN	0.9015
741	HTS	0.9015
742	C2U	0.9015
743	DBJ	0.9014
744	HYP	0.9014
745	MT0	0.9013
746	4MU	0.9012
747	DIU	0.9012
748	JZ5	0.9012
749	J6W	0.9012
750	OXZ	0.9011
751	MLA	0.9011
752	HIO	0.9010
753	XCZ	0.9010
754	MVN	0.9010
755	2FG	0.9009
756	DUB	0.9008
757	SWA	0.9007
758	A29	0.9006
759	TM4	0.9006
760	1SA	0.9006
761	PEL	0.9006
762	TTY	0.9006
763	8LG	0.9005
764	1DQ	0.9005
765	92Z	0.9004
766	93Q	0.9004
767	ISE	0.9004
768	AKH	0.9003
769	ADK	0.9002
770	M4T	0.9001
771	BZ2	0.9001
772	CXF	0.9000
773	PAC	0.8999
774	WOO	0.8999
775	FBS	0.8997
776	280	0.8997
777	9X7	0.8995
778	2FY	0.8995
779	KIV	0.8995
780	SHG	0.8995
781	BP9	0.8994
782	HJP	0.8994
783	MAQ	0.8992
784	268	0.8992
785	K5W	0.8991
786	3MH	0.8991
787	FCA	0.8990
788	44V	0.8990
789	9CL	0.8990
790	LCN	0.8990
791	PQ0	0.8989
792	ALL	0.8989
793	FOT	0.8987
794	GAF	0.8987
795	GLL	0.8987
796	FP2	0.8986
797	4ME	0.8984
798	0N7	0.8983
799	LKA	0.8983
800	L99	0.8982
801	9CA	0.8980
802	HSE	0.8979
803	NDM	0.8977
804	EYK	0.8977
805	HQJ	0.8976
806	S76	0.8976
807	DOR	0.8975
808	EXO	0.8975
809	INE	0.8972
810	069	0.8970
811	GOO	0.8969
812	AW5	0.8967
813	MLI	0.8966
814	JZ4	0.8965
815	495	0.8963
816	2AF	0.8963
817	DHK	0.8962
818	8K2	0.8960
819	IP0	0.8960
820	P2D	0.8959
821	HZQ	0.8957
822	G4D	0.8957
823	4TU	0.8956
824	TAR	0.8953
825	3IT	0.8953
826	PRY	0.8950
827	4XX	0.8948
828	RM4	0.8948
829	MAN	0.8947
830	76X	0.8947
831	SR1	0.8947
832	X6X	0.8946
833	39A	0.8945
834	3R6	0.8945
835	GZL	0.8945
836	3BU	0.8945
837	E1T	0.8944
838	NID	0.8942
839	1IT	0.8942
840	TBP	0.8942
841	6ME	0.8942
842	149	0.8941
843	X05	0.8940
844	PRS	0.8940
845	4J8	0.8940
846	5WY	0.8940
847	4SD	0.8940
848	PIM	0.8938
849	GDE	0.8937
850	PYQ	0.8936
851	PMB	0.8936
852	52C	0.8935
853	FBJ	0.8933
854	KPL	0.8931
855	KBB	0.8931
856	FRU	0.8931
857	QX4	0.8930
858	X0V	0.8928
859	DNF	0.8928
860	PAF	0.8927
861	DS0	0.8927
862	258	0.8926
863	K17	0.8925
864	3SL	0.8924
865	PD2	0.8924
866	0FN	0.8923
867	ARA	0.8923
868	BNS	0.8921
869	H3M	0.8920
870	THE	0.8918
871	SIN	0.8918
872	PA1	0.8918
873	JFD	0.8917
874	1U6	0.8917
875	25T	0.8915
876	BMA	0.8914
877	HPY	0.8914
878	QY9	0.8913
879	FUF	0.8913
880	Z6J	0.8912
881	PRF	0.8911
882	D1X	0.8911
883	YTB	0.8911
884	F4E	0.8910
885	DMJ	0.8910
886	LSA	0.8910
887	M2H	0.8909
888	TMT	0.8909
889	AL0	0.8909
890	APZ	0.8908
891	A13	0.8908
892	YHO	0.8908
893	9YL	0.8905
894	GUA	0.8905
895	PFB	0.8900
896	SKM	0.8897
897	6FZ	0.8897
898	2A7	0.8896
899	7ZE	0.8896
900	1XX	0.8896
901	VAL	0.8894
902	MRZ	0.8893
903	GXL	0.8892
904	PIY	0.8892
905	JXN	0.8891
906	INS	0.8891
907	TBS	0.8889
908	RBL	0.8889
909	TYL	0.8887
910	R2B	0.8885
911	EVA	0.8885
912	2ZQ	0.8884
913	ICB	0.8884
914	PEP	0.8884
915	4FH	0.8883
916	9FE	0.8883
917	URQ	0.8883
918	6UA	0.8883
919	HIU	0.8883
920	HXX	0.8882
921	3MA	0.8881
922	CYS	0.8881
923	SRO	0.8880
924	1DH	0.8878
925	ESX	0.8877
926	B24	0.8876
927	GIV	0.8875
928	HC4	0.8875
929	E60	0.8873
930	QPR	0.8873
931	ICC	0.8873
932	PXM	0.8873
933	2F6	0.8872
934	34D	0.8871
935	9TY	0.8871
936	1LN	0.8871
937	9ZE	0.8870
938	C5J	0.8870
939	ZZ3	0.8870
940	APY	0.8869
941	FA1	0.8867
942	UEG	0.8866
943	DHS	0.8866
944	KBG	0.8866
945	FCB	0.8866
946	GCO	0.8866
947	RNS	0.8865
948	FUD	0.8865
949	PYJ	0.8865
950	ESP	0.8865
951	MZW	0.8863
952	XYL	0.8862
953	X09	0.8860
954	6KT	0.8860
955	YIO	0.8860
956	TZL	0.8859
957	94N	0.8859
958	COI	0.8857
959	DPR	0.8856
960	BDF	0.8855
961	FUM	0.8853
962	DEE	0.8852
963	92P	0.8852
964	NXA	0.8852
965	1AL	0.8848
966	23J	0.8848
967	0F9	0.8848
968	HX2	0.8844
969	YAN	0.8843
970	FLA	0.8842
971	OHP	0.8841
972	TT4	0.8840
973	SXS	0.8839
974	24T	0.8839
975	FBT	0.8839
976	K8X	0.8837
977	IJZ	0.8836
978	DTU	0.8836
979	6LW	0.8835
980	F12	0.8835
981	8W9	0.8835
982	MSR	0.8835
983	D07	0.8834
984	CEJ	0.8832
985	7VJ	0.8832
986	QSH	0.8831
987	45L	0.8830
988	2KT	0.8829
989	APG	0.8829
990	ASN	0.8826
991	KYA	0.8826
992	7ME	0.8825
993	CFF	0.8824
994	SOR	0.8823
995	9RW	0.8820
996	GVG	0.8820
997	DSN	0.8820
998	KIB	0.8819
999	KIA	0.8819
1000	SS2	0.8819
1001	E7S	0.8819
1002	HA7	0.8819
1003	3V4	0.8816
1004	329	0.8816
1005	R8A	0.8816
1006	42J	0.8815
1007	BNF	0.8814
1008	CRN	0.8814
1009	3PY	0.8813
1010	GCB	0.8811
1011	AMH	0.8810
1012	RPQ	0.8810
1013	FGZ	0.8805
1014	NEQ	0.8804
1015	CIZ	0.8804
1016	JZ0	0.8803
1017	95Z	0.8803
1018	FK8	0.8802
1019	FPK	0.8801
1020	M0W	0.8801
1021	SPV	0.8800
1022	0LH	0.8800
1023	AAE	0.8800
1024	PEY	0.8799
1025	PHE	0.8799
1026	8G0	0.8794
1027	MFB	0.8793
1028	HYN	0.8793
1029	6HQ	0.8793
1030	ASC	0.8792
1031	Q02	0.8791
1032	L5V	0.8790
1033	AFR	0.8790
1034	9KT	0.8788
1035	GXE	0.8787
1036	FDK	0.8786
1037	AX2	0.8786
1038	RNT	0.8784
1039	2XX	0.8784
1040	GJZ	0.8784
1041	CLZ	0.8783
1042	SMN	0.8782
1043	IAC	0.8780
1044	13X	0.8779
1045	Z5P	0.8778
1046	KG7	0.8777
1047	12B	0.8776
1048	BK9	0.8775
1049	SN4	0.8775
1050	NCT	0.8774
1051	NVI	0.8774
1052	IWT	0.8773
1053	MBG	0.8772
1054	SER	0.8770
1055	1GN	0.8769
1056	1AB	0.8768
1057	YSO	0.8766
1058	EDG	0.8764
1059	680	0.8761
1060	BCF	0.8760
1061	HFB	0.8760
1062	CEE	0.8760
1063	LNR	0.8759
1064	ITN	0.8759
1065	MRY	0.8759
1066	LYL	0.8756
1067	BBF	0.8755
1068	2TQ	0.8754
1069	JUG	0.8753
1070	GLU	0.8753
1071	C2Y	0.8751
1072	FH2	0.8751
1073	BR8	0.8746
1074	3AY	0.8746
1075	TOF	0.8745
1076	2ZX	0.8742
1077	ESI	0.8742
1078	JND	0.8742
1079	SNU	0.8741
1080	THR	0.8741
1081	EDR	0.8739
1082	J9N	0.8739
1083	ADA	0.8739
1084	4VY	0.8737
1085	ZXD	0.8736
1086	R67	0.8736
1087	SVD	0.8735
1088	4SX	0.8732
1089	5ZE	0.8732
1090	OA3	0.8730
1091	6TZ	0.8730
1092	YPN	0.8729
1093	4XV	0.8728
1094	4NB	0.8726
1095	CN0	0.8725
1096	MBN	0.8724
1097	13P	0.8721
1098	AHB	0.8720
1099	5XB	0.8720
1100	ALO	0.8719
1101	IBF	0.8719
1102	LEU	0.8717
1103	7B3	0.8716
1104	IPH	0.8716
1105	CPZ	0.8716
1106	XLS	0.8709
1107	285	0.8709
1108	G3P	0.8709
1109	G3H	0.8709
1110	XXP	0.8708
1111	PQK	0.8707
1112	TZF	0.8706
1113	F1A	0.8705
1114	39O	0.8705
1115	PH2	0.8703
1116	PBE	0.8702
1117	0FK	0.8702
1118	VOH	0.8702
1119	PHH	0.8701
1120	209	0.8701
1121	2FQ	0.8701
1122	TZE	0.8700
1123	EN1	0.8700
1124	NF3	0.8699
1125	JG8	0.8699
1126	GLF	0.8698
1127	SEP	0.8697
1128	G1O	0.8696
1129	428	0.8694
1130	4XS	0.8692
1131	HCS	0.8691
1132	DGY	0.8690
1133	XIX	0.8689
1134	JTH	0.8689
1135	MAJ	0.8689
1136	ZYR	0.8689
1137	9PO	0.8688
1138	MSN	0.8688
1139	449	0.8688
1140	NVU	0.8688
1141	5CL	0.8687
1142	3AP	0.8687
1143	A2Q	0.8685
1144	98J	0.8683
1145	4PW	0.8682
1146	WDL	0.8680
1147	SD4	0.8679
1148	H33	0.8678
1149	2AP	0.8678
1150	SNO	0.8677
1151	TTO	0.8673
1152	A09	0.8670
1153	M4S	0.8669
1154	4RU	0.8669
1155	RNO	0.8667
1156	4AP	0.8666
1157	HVK	0.8665
1158	I2M	0.8663
1159	HRZ	0.8663
1160	M3H	0.8663
1161	8CL	0.8662
1162	OW7	0.8660
1163	LRH	0.8660
1164	OMD	0.8660
1165	OGA	0.8660
1166	ERH	0.8659
1167	DPZ	0.8658
1168	5LA	0.8658
1169	I3E	0.8658
1170	CIT	0.8657
1171	948	0.8655
1172	O7U	0.8655
1173	K22	0.8654
1174	ARW	0.8654
1175	SF9	0.8653
1176	PHT	0.8652
1177	LI6	0.8651
1178	HDA	0.8650
1179	8HC	0.8650
1180	HHR	0.8650
1181	F3B	0.8650
1182	GLT	0.8649
1183	5AN	0.8649
1184	1HN	0.8647
1185	K32	0.8647
1186	40E	0.8645
1187	GJP	0.8640
1188	BVC	0.8640
1189	QMP	0.8640
1190	ABA	0.8640
1191	ICF	0.8640
1192	PIH	0.8640
1193	DA4	0.8639
1194	HHN	0.8638
1195	2FT	0.8637
1196	PCI	0.8637
1197	K6X	0.8636
1198	278	0.8636
1199	260	0.8633
1200	3QV	0.8632
1201	1KP	0.8632
1202	0W1	0.8631
1203	B5D	0.8630
1204	0OC	0.8625
1205	12M	0.8624
1206	KMT	0.8621
1207	RUU	0.8619
1208	2KA	0.8617
1209	NTM	0.8617
1210	Q7A	0.8617
1211	DQN	0.8613
1212	UNJ	0.8611
1213	4P0	0.8610
1214	8XL	0.8609
1215	LGA	0.8608
1216	MET	0.8608
1217	2HC	0.8606
1218	FBU	0.8604
1219	51F	0.8602
1220	AJY	0.8600
1221	H7Y	0.8600
1222	091	0.8600
1223	EV0	0.8599
1224	W81	0.8594
1225	BVG	0.8593
1226	1L5	0.8593
1227	FDR	0.8592
1228	SNE	0.8588
1229	ZVO	0.8587
1230	KTW	0.8579
1231	LQ2	0.8571
1232	ZWZ	0.8570
1233	TWO	0.8570
1234	SEJ	0.8566
1235	7VP	0.8560
1236	GLN	0.8560
1237	GZ3	0.8557
1238	RAT	0.8551
1239	LER	0.8537
1240	TCZ	0.8532
1241	Q71	0.8527
1242	AN3	0.8525
1243	4BL	0.8521
1244	GGL	0.8520

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

Pocket No.: 1; Query (leader) PDB : 4KQI; Ligand: RBZ; 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: 4kqi.bio1) has 45 residues
No:	Leader PDB	Ligand	Sequence Similarity

Pocket No.: 2; Query (leader) PDB : 4KQI; Ligand: RBZ; 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: 4kqi.bio1) has 45 residues
No:	Leader PDB	Ligand	Sequence Similarity

Pocket No.: 3; Query (leader) PDB : 4KQI; Ligand: NIO; 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: 4kqi.bio1) has 45 residues
No:	Leader PDB	Ligand	Sequence Similarity

Pocket No.: 4; Query (leader) PDB : 4KQI; Ligand: NIO; 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: 4kqi.bio1) has 45 residues
No:	Leader PDB	Ligand	Sequence Similarity

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