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Showing PDB: 1L4N

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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
1L4N	2 Å	EC: 2.4.2.21	CRYSTAL STRUCTURE OF COBT COMPLEXED WITH 2-AMINOPHENOL	SALMONELLA ENTERICA	COBT COBALAMIN SYNTHETIC ENZYME PHOSPHORIBOSYLTRANSFERASEDIMETHYLBENZIMIDAZOLE NICOTINATE MONONUCLEOTIDE TRANSFERA
Ref.:	STRUCTURAL STUDIES OF THE L-THREONINE-O-3-PHOSPHATE DECARBOXYLASE (COBD) ENZYME FROM SALMONELLA ENTERIC APO, SUBSTRATE, AND PRODUCT-ALDIMINE COMPLEXES. BIOCHEMISTRY V. 41 9079 2002

Ligand

Ligand	Chain:Residue	Validity	Ligand Warnings	Binding Data	NGL Viewer	Molecular Weight (Da)	Formula	SMILES
2AF	A:990;	Valid;	none;	submit data		109.126	C6 H7 N O	c1ccc...
NIO	A:991;	Valid;	none;	submit data		123.109	C6 H5 N O2	c1cc(...
PO4	A:992;	Invalid;	none;	submit data		94.971	O4 P	[O-]P...

View in 3D viewer

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: 2AF; Similar ligands found: 2

No:	Ligand	ECFP6 Tc	MDL keys Tc
1	2AF	1	1
2	CAQ	0.526316	0.6

Ligand no: 2; Ligand: NIO; Similar ligands found: 6

No:	Ligand	ECFP6 Tc	MDL keys Tc
1	NIO	1	1
2	PQM	0.512821	0.789474
3	5F8	0.487805	0.789474
4	BEZ	0.433333	0.625
5	5HN	0.428571	0.695652
6	61O	0.418605	0.714286

Similar Ligands (3D)

Ligand no: 1; Ligand: 2AF; Similar ligands found: 671

No:	Ligand	Similarity coefficient
1	3ZQ	1.0281
2	40O	1.0000
3	FP2	1.0000
4	92Z	1.0000
5	1AN	1.0000
6	8LG	1.0000
7	L89	1.0000
8	76X	1.0000
9	93Q	1.0000
10	JZ0	1.0000
11	OXE	1.0000
12	2CH	0.9980
13	HTS	0.9979
14	938	0.9976
15	BEW	0.9960
16	YAN	0.9949
17	6X8	0.9915
18	MMZ	0.9796
19	KSW	0.9786
20	MB3	0.9785
21	DTI	0.9773
22	0TR	0.9759
23	HSL	0.9753
24	7CZ	0.9741
25	LXC	0.9741
26	285	0.9737
27	XYP	0.9724
28	1PT	0.9702
29	URF	0.9697
30	WBU	0.9677
31	TDR	0.9668
32	5UC	0.9667
33	NK	0.9667
34	4ZE	0.9663
35	MWM	0.9659
36	PYD	0.9655
37	ICP	0.9655
38	H3M	0.9650
39	DMI	0.9646
40	1MC	0.9643
41	2MP	0.9641
42	MCT	0.9638
43	CYT	0.9637
44	34A	0.9632
45	A1U	0.9630
46	284	0.9627
47	RSF	0.9626
48	CRS	0.9624
49	XBZ	0.9624
50	0R0	0.9622
51	4XX	0.9622
52	JZ3	0.9621
53	TH0	0.9616
54	XYD	0.9616
55	RCO	0.9614
56	URA	0.9613
57	DUC	0.9612
58	QOS	0.9610
59	43M	0.9610
60	26D	0.9607
61	LG3	0.9606
62	R8A	0.9601
63	TMT	0.9600
64	2AC	0.9598
65	CXL	0.9591
66	TM7	0.9590
67	4JO	0.9588
68	3MC	0.9580
69	280	0.9576
70	3CH	0.9575
71	3FA	0.9568
72	MZG	0.9565
73	TMZ	0.9564
74	4JJ	0.9564
75	4HO	0.9563
76	286	0.9561
77	4AX	0.9560
78	DXX	0.9559
79	HT4	0.9558
80	LG5	0.9557
81	5MH	0.9555
82	JZ2	0.9551
83	CYH	0.9547
84	MWJ	0.9547
85	4CL	0.9546
86	BR9	0.9545
87	BVF	0.9545
88	MBD	0.9543
89	2YU	0.9541
90	IPH	0.9540
91	8GF	0.9538
92	FFP	0.9535
93	27Y	0.9534
94	HVK	0.9532
95	PYG	0.9532
96	XYS	0.9523
97	5JC	0.9522
98	HPY	0.9522
99	FLM	0.9520
100	JZ1	0.9514
101	2C9	0.9510
102	AHR	0.9507
103	1XX	0.9499
104	J1Z	0.9496
105	2AP	0.9496
106	TLD	0.9495
107	MBN	0.9494
108	NEQ	0.9492
109	3MH	0.9490
110	9PO	0.9489
111	GMN	0.9482
112	2MY	0.9480
113	3AP	0.9479
114	FPY	0.9474
115	HGQ	0.9473
116	IUR	0.9473
117	3CE	0.9470
118	DUB	0.9470
119	HRZ	0.9464
120	2IM	0.9464
121	7EX	0.9462
122	DEN	0.9459
123	LGA	0.9457
124	0CT	0.9453
125	TM4	0.9453
126	4AP	0.9452
127	2CM	0.9452
128	Y8I	0.9448
129	GVH	0.9446
130	BZF	0.9444
131	HAI	0.9443
132	HEW	0.9441
133	6MH	0.9436
134	64K	0.9435
135	M3T	0.9428
136	8CL	0.9427
137	CIG	0.9427
138	WOT	0.9426
139	IND	0.9425
140	BZI	0.9421
141	B3R	0.9419
142	GXE	0.9411
143	0R1	0.9410
144	IDH	0.9408
145	A2Q	0.9393
146	0MK	0.9390
147	4H2	0.9388
148	V1L	0.9383
149	MPI	0.9382
150	4JP	0.9381
151	CEJ	0.9379
152	ARA	0.9379
153	LZ1	0.9377
154	ECE	0.9373
155	F05	0.9372
156	RIP	0.9372
157	YHO	0.9371
158	DA1	0.9369
159	IDM	0.9368
160	HIU	0.9368
161	HHQ	0.9360
162	PCR	0.9359
163	ADE	0.9358
164	275	0.9353
165	YTB	0.9352
166	ICC	0.9349
167	FUC	0.9348
168	1WG	0.9342
169	HQE	0.9333
170	SVN	0.9328
171	4CH	0.9328
172	PLQ	0.9323
173	24T	0.9323
174	2KT	0.9322
175	150	0.9322
176	4DX	0.9320
177	TTO	0.9320
178	HPA	0.9319
179	DGY	0.9317
180	9EW	0.9315
181	FPN	0.9313
182	HYN	0.9312
183	9HX	0.9307
184	DSN	0.9307
185	BTE	0.9306
186	9DA	0.9306
187	7HP	0.9305
188	45C	0.9301
189	6MP	0.9297
190	FOA	0.9294
191	2CQ	0.9290
192	HLR	0.9290
193	PM6	0.9288
194	HHN	0.9286
195	OXM	0.9285
196	25R	0.9284
197	OXL	0.9283
198	LG4	0.9282
199	MAK	0.9280
200	7WA	0.9277
201	ES4	0.9276
202	KG7	0.9272
203	E60	0.9269
204	2OP	0.9269
205	DMG	0.9267
206	L60	0.9264
207	3Z7	0.9259
208	ARB	0.9254
209	23A	0.9252
210	NIS	0.9251
211	MLT	0.9247
212	WDL	0.9243
213	24B	0.9243
214	10L	0.9242
215	PIH	0.9240
216	JZ9	0.9240
217	F4Z	0.9236
218	HGY	0.9231
219	PYR	0.9230
220	25W	0.9228
221	OXD	0.9228
222	GBD	0.9226
223	G6D	0.9226
224	PXY	0.9225
225	LAC	0.9224
226	6UA	0.9224
227	SWD	0.9224
228	DAB	0.9224
229	CYS	0.9223
230	PYC	0.9220
231	BP1	0.9218
232	2DR	0.9215
233	HMH	0.9214
234	ZZT	0.9214
235	0RW	0.9213
236	94N	0.9212
237	AX2	0.9212
238	FYU	0.9211
239	KIV	0.9210
240	TC7	0.9209
241	L3Q	0.9208
242	HGW	0.9207
243	HY3	0.9205
244	282	0.9202
245	OXQ	0.9201
246	265	0.9200
247	DAL	0.9199
248	ALA	0.9198
249	BR8	0.9195
250	SER	0.9194
251	SEJ	0.9194
252	13X	0.9194
253	3AY	0.9193
254	PRO	0.9191
255	278	0.9190
256	FUL	0.9187
257	BNZ	0.9185
258	DFU	0.9184
259	4ZC	0.9183
260	XXR	0.9181
261	B20	0.9181
262	SAL	0.9181
263	0PY	0.9180
264	1AC	0.9180
265	6M4	0.9178
266	XIX	0.9176
267	6HQ	0.9172
268	4JN	0.9170
269	93B	0.9169
270	MLA	0.9168
271	260	0.9167
272	25T	0.9164
273	4JU	0.9162
274	PHZ	0.9153
275	2MH	0.9149
276	BML	0.9146
277	MLI	0.9145
278	M2H	0.9144
279	MZ0	0.9143
280	4HS	0.9142
281	ABE	0.9140
282	JAB	0.9136
283	5ZE	0.9134
284	YCP	0.9130
285	HMU	0.9128
286	SYN	0.9127
287	1DW	0.9125
288	JBE	0.9124
289	HBX	0.9120
290	FCA	0.9120
291	1MR	0.9120
292	NSP	0.9119
293	C5J	0.9113
294	6M9	0.9112
295	NBZ	0.9110
296	2ZX	0.9108
297	35C	0.9107
298	PYF	0.9107
299	BEZ	0.9106
300	VNJ	0.9106
301	GAG	0.9106
302	5AC	0.9104
303	8H8	0.9104
304	2PC	0.9104
305	1DH	0.9101
306	P1R	0.9097
307	ALO	0.9096
308	PYM	0.9094
309	3PY	0.9086
310	3SK	0.9086
311	GOL	0.9085
312	3U4	0.9083
313	47J	0.9083
314	NPY	0.9083
315	TZC	0.9079
316	TP5	0.9077
317	BEN	0.9077
318	6AI	0.9076
319	JBN	0.9072
320	ES6	0.9072
321	3MT	0.9071
322	QUZ	0.9071
323	2RA	0.9071
324	NAK	0.9066
325	BE2	0.9064
326	5Y9	0.9062
327	4SV	0.9062
328	VAL	0.9061
329	FPI	0.9060
330	DBB	0.9059
331	A3B	0.9059
332	6PC	0.9059
333	1WD	0.9058
334	3XX	0.9057
335	BAQ	0.9057
336	ABN	0.9052
337	APY	0.9050
338	IOL	0.9050
339	NCA	0.9049
340	F5B	0.9045
341	FUF	0.9045
342	FPK	0.9044
343	GLC	0.9044
344	PY7	0.9040
345	AZF	0.9040
346	JIF	0.9040
347	ERH	0.9040
348	T6C	0.9038
349	BZX	0.9037
350	273	0.9035
351	BAM	0.9035
352	RIB	0.9035
353	EXO	0.9034
354	RP7	0.9033
355	AMT	0.9032
356	OXZ	0.9030
357	7MH	0.9028
358	PYJ	0.9027
359	IT2	0.9027
360	1CB	0.9026
361	TAR	0.9020
362	GOO	0.9019
363	IFM	0.9016
364	12M	0.9016
365	SMV	0.9016
366	JKE	0.9016
367	23W	0.9015
368	1XN	0.9014
369	60P	0.9012
370	BUO	0.9005
371	B24	0.9005
372	ALQ	0.9004
373	7WV	0.9003
374	MLM	0.9002
375	ABA	0.9000
376	DTL	0.8999
377	IP0	0.8999
378	CIZ	0.8998
379	HUI	0.8994
380	RAM	0.8994
381	G3F	0.8993
382	3TR	0.8991
383	2CK	0.8990
384	ADZ	0.8989
385	NBE	0.8983
386	GBL	0.8983
387	DFB	0.8981
388	AMC	0.8971
389	PAF	0.8969
390	5Q0	0.8968
391	TH7	0.8967
392	9CL	0.8966
393	5MB	0.8963
394	ES9	0.8962
395	4XR	0.8961
396	DCY	0.8961
397	KYD	0.8960
398	ATQ	0.8960
399	2AI	0.8951
400	9DG	0.8951
401	O72	0.8949
402	HQY	0.8948
403	JFD	0.8947
404	HOW	0.8946
405	261	0.8945
406	4MZ	0.8942
407	F81	0.8941
408	1DU	0.8940
409	DCD	0.8938
410	5IQ	0.8937
411	ES1	0.8936
412	5SG	0.8935
413	GUN	0.8935
414	JPZ	0.8934
415	AZA	0.8933
416	5H1	0.8932
417	6AP	0.8931
418	1NP	0.8931
419	NIO	0.8930
420	A2F	0.8930
421	N5J	0.8930
422	1LM	0.8929
423	NVI	0.8929
424	ADK	0.8928
425	2MZ	0.8927
426	290	0.8927
427	TF4	0.8925
428	5MP	0.8924
429	C21	0.8923
430	2XX	0.8923
431	FLA	0.8922
432	IGA	0.8922
433	LER	0.8922
434	1LQ	0.8920
435	2K4	0.8920
436	1MZ	0.8920
437	4YS	0.8918
438	JBH	0.8917
439	FK1	0.8915
440	5MI	0.8915
441	F60	0.8914
442	7B4	0.8913
443	H4N	0.8913
444	ASP	0.8911
445	TBP	0.8910
446	3ZS	0.8910
447	LMR	0.8909
448	PZA	0.8908
449	11S	0.8907
450	P3K	0.8904
451	1SQ	0.8903
452	3MA	0.8902
453	14O	0.8901
454	XAN	0.8899
455	M58	0.8896
456	8NY	0.8895
457	BGC	0.8895
458	EQT	0.8893
459	24W	0.8893
460	CFP	0.8892
461	O7U	0.8891
462	BVC	0.8890
463	HH8	0.8889
464	PRS	0.8888
465	QSC	0.8884
466	BOA	0.8883
467	VGL	0.8883
468	AZG	0.8880
469	R2B	0.8880
470	1XM	0.8878
471	TFB	0.8878
472	7HQ	0.8876
473	270	0.8873
474	TCZ	0.8873
475	CRN	0.8871
476	7W4	0.8869
477	Z6J	0.8869
478	YH7	0.8869
479	4XH	0.8868
480	MR3	0.8864
481	SS1	0.8864
482	KPL	0.8860
483	THR	0.8858
484	C2A	0.8857
485	NTN	0.8856
486	141	0.8855
487	1AB	0.8855
488	82I	0.8853
489	6GU	0.8853
490	8S0	0.8851
491	192	0.8850
492	GIO	0.8847
493	H76	0.8845
494	5KX	0.8844
495	03W	0.8842
496	M1A	0.8841
497	FP1	0.8840
498	DX4	0.8838
499	MZY	0.8836
500	UNU	0.8834
501	GRE	0.8834
502	9TY	0.8834
503	4PW	0.8834
504	3DO	0.8833
505	FUB	0.8832
506	MSN	0.8831
507	EDG	0.8830
508	G2F	0.8830
509	5AN	0.8829
510	2ZV	0.8829
511	1LN	0.8828
512	KKN	0.8825
513	AKB	0.8825
514	NOJ	0.8824
515	ISN	0.8824
516	I3A	0.8823
517	JAE	0.8821
518	MZW	0.8820
519	JZ4	0.8819
520	2LP	0.8817
521	JZ6	0.8817
522	RM4	0.8816
523	ITN	0.8813
524	PBC	0.8812
525	P2D	0.8811
526	6F0	0.8809
527	HBA	0.8807
528	BHO	0.8806
529	BCP	0.8806
530	0CU	0.8805
531	6M1	0.8803
532	DPR	0.8802
533	5CL	0.8799
534	HH5	0.8798
535	AX7	0.8798
536	KOJ	0.8795
537	5RG	0.8795
538	IFL	0.8790
539	ASO	0.8790
540	B53	0.8790
541	BAE	0.8783
542	HBS	0.8781
543	NOY	0.8780
544	6SP	0.8779
545	XM0	0.8773
546	BAL	0.8772
547	XQG	0.8772
548	ES7	0.8772
549	TLA	0.8767
550	FCB	0.8766
551	URQ	0.8766
552	LCN	0.8764
553	6CS	0.8763
554	HX3	0.8760
555	RNS	0.8759
556	AAE	0.8757
557	8GC	0.8757
558	51F	0.8753
559	HVQ	0.8753
560	BSX	0.8750
561	MFB	0.8750
562	MRY	0.8749
563	2MI	0.8748
564	HIO	0.8748
565	54G	0.8745
566	GTQ	0.8742
567	P92	0.8742
568	5NU	0.8741
569	PRY	0.8740
570	5M0	0.8740
571	ABV	0.8739
572	S76	0.8739
573	HSE	0.8739
574	BVG	0.8738
575	DBH	0.8737
576	3RK	0.8736
577	XQ0	0.8736
578	BYZ	0.8736
579	ASN	0.8730
580	RM1	0.8730
581	3HA	0.8729
582	3M0	0.8729
583	Q88	0.8726
584	ES3	0.8725
585	M1E	0.8725
586	LZM	0.8725
587	2A7	0.8725
588	5MK	0.8724
589	3F0	0.8721
590	LDU	0.8720
591	3OH	0.8719
592	5WV	0.8717
593	INS	0.8717
594	AC0	0.8716
595	SX1	0.8715
596	UEG	0.8715
597	67N	0.8714
598	AUD	0.8713
599	9TZ	0.8707
600	9X7	0.8705
601	CWM	0.8704
602	ES0	0.8701
603	OAA	0.8700
604	3NT	0.8700
605	AGK	0.8696
606	OHG	0.8693
607	GIF	0.8690
608	JBK	0.8686
609	1P7	0.8685
610	PYZ	0.8680
611	DMJ	0.8680
612	5HN	0.8678
613	42A	0.8676
614	6KX	0.8670
615	5B1	0.8670
616	DMD	0.8668
617	ZZ3	0.8664
618	URP	0.8663
619	HHA	0.8660
620	MNM	0.8645
621	KJY	0.8641
622	3HB	0.8640
623	PHB	0.8640
624	TZE	0.8640
625	BHA	0.8639
626	GAB	0.8638
627	3AB	0.8636
628	32O	0.8634
629	R8S	0.8634
630	4VP	0.8632
631	DOB	0.8631
632	3WA	0.8630
633	4M0	0.8629
634	MRZ	0.8627
635	DTU	0.8627
636	5CU	0.8624
637	3ID	0.8624
638	FA0	0.8621
639	9MG	0.8621
640	14J	0.8620
641	PAV	0.8620
642	PXL	0.8619
643	H8N	0.8615
644	3DM	0.8606
645	WOO	0.8603
646	IPB	0.8602
647	MAN	0.8600
648	7VJ	0.8593
649	39A	0.8592
650	LGC	0.8589
651	JBQ	0.8585
652	PBE	0.8584
653	HFB	0.8583
654	G5V	0.8582
655	2EZ	0.8580
656	4JL	0.8580
657	RUU	0.8580
658	T2C	0.8574
659	V55	0.8574
660	ALL	0.8564
661	BP9	0.8562
662	4JM	0.8560
663	SS2	0.8550
664	MAE	0.8549
665	C2B	0.8540
666	ARW	0.8540
667	HXX	0.8532
668	03V	0.8529
669	32X	0.8525
670	LRH	0.8523
671	COU	0.8522

Ligand no: 2; Ligand: NIO; Similar ligands found: 1243

No:	Ligand	Similarity coefficient
1	BEN	1.0000
2	NCA	1.0000
3	BAM	1.0000
4	BE7	1.0000
5	UNU	1.0000
6	YCP	1.0000
7	PBC	1.0000
8	JZ7	1.0000
9	BNS	1.0000
10	NTN	1.0000
11	6PC	1.0000
12	QSC	1.0000
13	SS1	1.0000
14	PZA	1.0000
15	VGL	1.0000
16	NBZ	1.0000
17	AC0	1.0000
18	GLA	1.0000
19	SS2	0.9992
20	M58	0.9968
21	FOA	0.9931
22	IT2	0.9903
23	TZC	0.9895
24	PYC	0.9892
25	AMC	0.9888
26	TP5	0.9888
27	PRO	0.9879
28	C21	0.9872
29	DEN	0.9863
30	IDM	0.9861
31	2PC	0.9858
32	PHB	0.9845
33	IND	0.9842
34	DPR	0.9835
35	273	0.9828
36	JBN	0.9826
37	RSO	0.9823
38	265	0.9823
39	LZ1	0.9821
40	NPO	0.9819
41	MRZ	0.9807
42	0R1	0.9801
43	ABN	0.9798
44	HBX	0.9796
45	HBD	0.9796
46	SYN	0.9795
47	GAG	0.9794
48	4JP	0.9791
49	CFI	0.9788
50	SMV	0.9788
51	HY1	0.9781
52	ISZ	0.9781
53	GVH	0.9780
54	MPI	0.9779
55	BHO	0.9777
56	BZF	0.9776
57	GBD	0.9776
58	1Y6	0.9767
59	JZ5	0.9765
60	PRS	0.9762
61	BZI	0.9760
62	5AC	0.9759
63	FEH	0.9756
64	OAA	0.9753
65	PY7	0.9752
66	4SV	0.9751
67	8GC	0.9750
68	2CK	0.9748
69	OXQ	0.9748
70	PAB	0.9748
71	60P	0.9747
72	SAL	0.9747
73	282	0.9746
74	4CS	0.9746
75	JZ9	0.9738
76	FAN	0.9738
77	BE2	0.9735
78	VNJ	0.9735
79	QUZ	0.9732
80	GAB	0.9732
81	54D	0.9730
82	JKE	0.9729
83	0CT	0.9729
84	NPY	0.9724
85	PYF	0.9722
86	3U4	0.9722
87	ES6	0.9719
88	JAB	0.9715
89	NBE	0.9714
90	NMJ	0.9713
91	7WV	0.9711
92	I1E	0.9710
93	3AB	0.9710
94	3NT	0.9706
95	PBZ	0.9694
96	3SK	0.9693
97	P72	0.9692
98	3HB	0.9691
99	1MR	0.9690
100	F05	0.9689
101	Z82	0.9685
102	1PT	0.9683
103	HYP	0.9682
104	7A8	0.9681
105	14J	0.9681
106	UYA	0.9680
107	4MA	0.9680
108	1DJ	0.9677
109	MNN	0.9675
110	SW7	0.9672
111	FPI	0.9672
112	MLT	0.9671
113	826	0.9670
114	1WD	0.9668
115	53C	0.9666
116	6M9	0.9662
117	FBM	0.9660
118	AC6	0.9659
119	9EW	0.9659
120	TPA	0.9659
121	HZP	0.9658
122	1DU	0.9658
123	8EZ	0.9655
124	WCE	0.9655
125	3OC	0.9654
126	JBE	0.9653
127	UY7	0.9652
128	6M4	0.9650
129	HIO	0.9648
130	174	0.9646
131	9CL	0.9645
132	OVV	0.9644
133	NIZ	0.9643
134	AX7	0.9643
135	UGC	0.9639
136	HY3	0.9634
137	BRT	0.9634
138	MXN	0.9631
139	HLR	0.9630
140	270	0.9630
141	PCA	0.9624
142	0RW	0.9622
143	SVN	0.9621
144	J1Z	0.9618
145	OK7	0.9615
146	FB2	0.9613
147	14O	0.9609
148	3BZ	0.9607
149	BZX	0.9594
150	DYA	0.9594
151	5H1	0.9591
152	PMB	0.9589
153	ABV	0.9589
154	F60	0.9582
155	FBJ	0.9582
156	XM0	0.9582
157	2K4	0.9581
158	2MI	0.9581
159	FQI	0.9578
160	HSM	0.9572
161	F9P	0.9570
162	ASP	0.9567
163	SRT	0.9563
164	TFB	0.9558
165	L3Q	0.9549
166	5MI	0.9549
167	T2C	0.9544
168	5MB	0.9542
169	HBA	0.9540
170	6AI	0.9540
171	XBT	0.9537
172	M6W	0.9532
173	LMR	0.9525
174	P92	0.9520
175	PYJ	0.9520
176	TZL	0.9518
177	COI	0.9518
178	ZBT	0.9518
179	DBH	0.9513
180	2RH	0.9510
181	RSF	0.9508
182	7WG	0.9505
183	ASN	0.9504
184	3M0	0.9501
185	PHU	0.9500
186	P9P	0.9499
187	HHA	0.9498
188	FE DB1	0.9497
189	CXF	0.9497
190	JBK	0.9493
191	4NC	0.9493
192	4VP	0.9492
193	PZI	0.9492
194	3ID	0.9490
195	3F0	0.9488
196	M4T	0.9486
197	1DQ	0.9483
198	3HA	0.9479
199	HPA	0.9479
200	THE	0.9475
201	TZE	0.9464
202	NK	0.9463
203	JAE	0.9461
204	11S	0.9461
205	271	0.9459
206	FBA	0.9457
207	GYE	0.9456
208	APY	0.9456
209	PEL	0.9452
210	B24	0.9452
211	DMD	0.9446
212	ES9	0.9445
213	PEA	0.9442
214	ISN	0.9440
215	10L	0.9437
216	7N0	0.9437
217	TH7	0.9436
218	SHA	0.9435
219	1P3	0.9433
220	INO	0.9433
221	H4N	0.9431
222	5NU	0.9430
223	DHB	0.9429
224	K34	0.9429
225	TEO	0.9429
226	40E	0.9427
227	QY9	0.9426
228	5WV	0.9423
229	FK1	0.9420
230	ADE	0.9420
231	XX2	0.9419
232	NNO	0.9418
233	BVC	0.9417
234	0TR	0.9414
235	ES7	0.9413
236	GJZ	0.9413
237	PAC	0.9413
238	SPA	0.9413
239	COU	0.9413
240	XYP	0.9410
241	9TW	0.9410
242	HSE	0.9409
243	KKN	0.9409
244	R8A	0.9408
245	AHR	0.9407
246	PRI	0.9406
247	3HM	0.9403
248	HVQ	0.9403
249	FCR	0.9401
250	NXA	0.9401
251	MYJ	0.9400
252	1WG	0.9400
253	2HO	0.9400
254	JB5	0.9397
255	N5J	0.9397
256	4JL	0.9396
257	1DV	0.9394
258	TLA	0.9392
259	JLZ	0.9392
260	CHB	0.9392
261	5CU	0.9391
262	CEE	0.9391
263	URF	0.9390
264	FP1	0.9389
265	FHB	0.9389
266	9DA	0.9388
267	93K	0.9388
268	8NY	0.9387
269	7HP	0.9387
270	XYL	0.9385
271	RB5	0.9385
272	2LP	0.9385
273	RIB	0.9383
274	1LQ	0.9382
275	69O	0.9382
276	4A3	0.9382
277	4M0	0.9382
278	BP9	0.9380
279	WOT	0.9380
280	NVI	0.9378
281	TH0	0.9376
282	67N	0.9376
283	SIN	0.9374
284	GUA	0.9372
285	J9T	0.9371
286	24W	0.9369
287	4P5	0.9369
288	JZ3	0.9367
289	5SG	0.9367
290	FA0	0.9367
291	9HX	0.9365
292	6MP	0.9365
293	03V	0.9365
294	ALO	0.9364
295	BHA	0.9364
296	5IQ	0.9363
297	1SQ	0.9363
298	51R	0.9363
299	4FS	0.9362
300	IMR	0.9360
301	ES1	0.9359
302	7WA	0.9358
303	LDU	0.9357
304	ES5	0.9356
305	TSU	0.9356
306	150	0.9355
307	QSB	0.9354
308	PM6	0.9351
309	FPY	0.9350
310	5Q0	0.9350
311	BVG	0.9350
312	51F	0.9350
313	KYD	0.9349
314	2AQ	0.9349
315	JPZ	0.9347
316	6M1	0.9347
317	M1A	0.9347
318	MAE	0.9347
319	FBV	0.9346
320	PG3	0.9345
321	45L	0.9344
322	4YS	0.9343
323	7W4	0.9341
324	1MC	0.9340
325	R1X	0.9338
326	R2B	0.9338
327	2CQ	0.9338
328	SJ5	0.9337
329	HX2	0.9337
330	LXC	0.9335
331	MZ0	0.9334
332	RMN	0.9332
333	MZW	0.9332
334	23A	0.9331
335	HQY	0.9331
336	4JM	0.9331
337	1DW	0.9331
338	XCZ	0.9330
339	KIV	0.9329
340	PLQ	0.9328
341	HDH	0.9328
342	1NP	0.9328
343	SD4	0.9327
344	DOB	0.9326
345	268	0.9326
346	6F0	0.9325
347	URQ	0.9325
348	SMN	0.9324
349	WBU	0.9323
350	98J	0.9323
351	1P7	0.9322
352	ORO	0.9322
353	IHB	0.9321
354	OCH	0.9320
355	OXC	0.9320
356	MAK	0.9320
357	H42	0.9320
358	FUM	0.9320
359	OXZ	0.9319
360	1AB	0.9319
361	OTR	0.9318
362	HCS	0.9317
363	3DO	0.9316
364	KOJ	0.9315
365	MCT	0.9315
366	3SL	0.9314
367	ITN	0.9314
368	4JT	0.9312
369	4JU	0.9312
370	GRE	0.9312
371	7MU	0.9312
372	280	0.9311
373	PKU	0.9310
374	8OZ	0.9309
375	2CO	0.9309
376	2MH	0.9309
377	HMH	0.9308
378	173	0.9308
379	IFM	0.9305
380	MRY	0.9304
381	Q88	0.9304
382	XQ0	0.9303
383	BP1	0.9302
384	JYD	0.9302
385	IP0	0.9301
386	DOR	0.9299
387	717	0.9298
388	NMG	0.9297
389	3PF	0.9297
390	PBE	0.9295
391	4ZE	0.9295
392	DS0	0.9294
393	DAS	0.9294
394	HH8	0.9293
395	9RW	0.9291
396	EDG	0.9291
397	TDR	0.9291
398	HSO	0.9288
399	5RG	0.9288
400	9TZ	0.9287
401	45C	0.9286
402	286	0.9285
403	ES4	0.9284
404	GTQ	0.9283
405	HQE	0.9283
406	DAB	0.9282
407	2AC	0.9282
408	FB1	0.9282
409	GRO	0.9281
410	4XH	0.9281
411	DA1	0.9280
412	MWM	0.9279
413	7CZ	0.9279
414	9X7	0.9279
415	6CS	0.9277
416	54G	0.9276
417	AW5	0.9275
418	4HO	0.9274
419	SAN	0.9274
420	QXW	0.9274
421	AAS	0.9271
422	275	0.9269
423	GLU	0.9269
424	ES0	0.9268
425	RHU	0.9268
426	OHG	0.9268
427	MLA	0.9266
428	0R0	0.9265
429	4XR	0.9265
430	JBH	0.9265
431	FBW	0.9264
432	BTE	0.9263
433	FPN	0.9263
434	URP	0.9262
435	LG4	0.9262
436	069	0.9262
437	XYD	0.9260
438	34D	0.9259
439	5B1	0.9258
440	ADZ	0.9258
441	FBS	0.9254
442	URS	0.9253
443	AL0	0.9252
444	QWN	0.9250
445	ET2	0.9250
446	BSX	0.9250
447	IPB	0.9250
448	H8N	0.9250
449	2AL	0.9250
450	1LN	0.9249
451	1SA	0.9249
452	D1X	0.9249
453	IQ0	0.9247
454	4J8	0.9247
455	IHG	0.9246
456	ILE	0.9244
457	2ZV	0.9243
458	278	0.9242
459	AZF	0.9240
460	XBZ	0.9240
461	ASC	0.9239
462	2MP	0.9238
463	AMS	0.9238
464	7B4	0.9236
465	VAL	0.9235
466	5M0	0.9235
467	34A	0.9234
468	O72	0.9234
469	CWM	0.9234
470	DE5	0.9234
471	4CL	0.9233
472	IZC	0.9233
473	5QY	0.9231
474	NOJ	0.9231
475	AZA	0.9227
476	A1U	0.9225
477	GIF	0.9224
478	5MK	0.9223
479	SNE	0.9222
480	25R	0.9219
481	PCR	0.9218
482	JZ2	0.9218
483	261	0.9217
484	ICP	0.9216
485	PYD	0.9216
486	AC5	0.9216
487	DTL	0.9215
488	MLI	0.9215
489	G3E	0.9212
490	A09	0.9211
491	1LM	0.9209
492	SPV	0.9208
493	ICF	0.9206
494	EQT	0.9203
495	9YL	0.9203
496	PIY	0.9203
497	PPR	0.9201
498	2D0	0.9201
499	4JJ	0.9201
500	DHK	0.9201
501	M3H	0.9200
502	V1L	0.9198
503	LT2	0.9198
504	AHB	0.9198
505	AGK	0.9197
506	CYH	0.9196
507	CXL	0.9196
508	DHS	0.9196
509	PRY	0.9196
510	HAI	0.9194
511	2DR	0.9193
512	36R	0.9193
513	CLW	0.9193
514	EKZ	0.9193
515	R8V	0.9193
516	C2B	0.9192
517	D48	0.9190
518	25W	0.9189
519	RM1	0.9189
520	27Y	0.9189
521	5OB	0.9189
522	SX1	0.9189
523	FYU	0.9188
524	CFP	0.9188
525	ECE	0.9186
526	258	0.9186
527	RBL	0.9186
528	I3A	0.9186
529	JZ4	0.9184
530	PAF	0.9183
531	C2A	0.9183
532	5UC	0.9182
533	HIS	0.9182
534	GZ3	0.9181
535	F4Z	0.9181
536	8K2	0.9180
537	LCN	0.9178
538	MZG	0.9178
539	Z6J	0.9177
540	PXY	0.9176
541	VGD	0.9176
542	DMG	0.9176
543	TAR	0.9175
544	NYL	0.9174
545	4ZA	0.9173
546	2IM	0.9172
547	ES2	0.9172
548	DCL	0.9172
549	1P8	0.9169
550	GXE	0.9168
551	PEQ	0.9168
552	0V5	0.9168
553	J9Q	0.9167
554	SE2	0.9166
555	EHM	0.9164
556	2EZ	0.9164
557	HH5	0.9164
558	GUN	0.9164
559	PEP	0.9163
560	K2T	0.9162
561	3ZQ	0.9161
562	HMU	0.9159
563	CRN	0.9159
564	JZ1	0.9158
565	5VM	0.9158
566	XUL	0.9158
567	AEF	0.9158
568	40O	0.9155
569	HT4	0.9155
570	5MH	0.9154
571	4WL	0.9154
572	3PY	0.9154
573	IFP	0.9152
574	BZ3	0.9152
575	TC7	0.9151
576	HX3	0.9150
577	GDE	0.9149
578	DHR	0.9147
579	C5J	0.9146
580	J5I	0.9145
581	G3P	0.9142
582	G3H	0.9142
583	LG3	0.9142
584	43M	0.9141
585	L99	0.9141
586	8CL	0.9139
587	URA	0.9139
588	FBB	0.9138
589	4FA	0.9137
590	MLM	0.9134
591	A2F	0.9132
592	1XN	0.9132
593	MBN	0.9131
594	6AP	0.9131
595	K5W	0.9131
596	JFJ	0.9131
597	THR	0.9130
598	2YU	0.9128
599	TIU	0.9127
600	CN0	0.9126
601	CIZ	0.9126
602	H3M	0.9124
603	N4B	0.9123
604	XLS	0.9122
605	4CH	0.9122
606	TM7	0.9121
607	5JC	0.9120
608	SKM	0.9119
609	G2F	0.9117
610	IPH	0.9116
611	93B	0.9116
612	290	0.9116
613	OVM	0.9116
614	FLA	0.9115
615	TTL	0.9115
616	9TY	0.9113
617	SVD	0.9113
618	ABE	0.9113
619	RCO	0.9111
620	A2Q	0.9111
621	DFB	0.9110
622	3XX	0.9110
623	L60	0.9109
624	AZG	0.9108
625	3AP	0.9107
626	DX4	0.9107
627	9DG	0.9107
628	HRZ	0.9106
629	MUC	0.9106
630	OVP	0.9106
631	CWS	0.9104
632	4AP	0.9104
633	2AP	0.9104
634	AKG	0.9104
635	JA8	0.9103
636	S76	0.9103
637	0CU	0.9103
638	YRL	0.9101
639	HHN	0.9100
640	ZXD	0.9100
641	P3K	0.9099
642	BR9	0.9099
643	T9G	0.9099
644	4AA	0.9098
645	FCA	0.9096
646	4NM	0.9096
647	MWJ	0.9096
648	LNR	0.9096
649	0P6	0.9095
650	PIM	0.9095
651	2PG	0.9095
652	269	0.9094
653	2A7	0.9093
654	BEW	0.9092
655	A13	0.9092
656	ICC	0.9091
657	3FH	0.9090
658	IOM	0.9089
659	BOA	0.9088
660	QMP	0.9087
661	BGC	0.9086
662	1M2	0.9084
663	AAE	0.9084
664	TTO	0.9083
665	A7W	0.9082
666	2TQ	0.9082
667	7HQ	0.9081
668	CAQ	0.9081
669	X0V	0.9081
670	24B	0.9079
671	SEP	0.9079
672	MR1	0.9078
673	KUF	0.9078
674	GZL	0.9077
675	CRS	0.9076
676	LER	0.9074
677	HVK	0.9074
678	FW5	0.9074
679	IFL	0.9074
680	8GF	0.9074
681	7W1	0.9073
682	4JN	0.9072
683	5QX	0.9072
684	P2D	0.9072
685	LDP	0.9072
686	264	0.9072
687	8H8	0.9071
688	259	0.9071
689	KPL	0.9070
690	NOY	0.9070
691	BML	0.9070
692	284	0.9069
693	SWD	0.9068
694	3HL	0.9066
695	4NG	0.9066
696	OKG	0.9066
697	QSH	0.9066
698	3CH	0.9065
699	CMS	0.9064
700	DGJ	0.9063
701	LG5	0.9063
702	4HS	0.9062
703	XYS	0.9062
704	LGA	0.9062
705	8CM	0.9061
706	141	0.9061
707	42A	0.9061
708	LEU	0.9061
709	G4D	0.9060
710	SYV	0.9060
711	97T	0.9060
712	EA1	0.9059
713	ARB	0.9058
714	XAN	0.9058
715	S2G	0.9058
716	IDH	0.9057
717	RUU	0.9057
718	XIY	0.9057
719	GLY GLY	0.9057
720	RBJ	0.9056
721	HPY	0.9056
722	ZZT	0.9055
723	IGA	0.9055
724	23W	0.9054
725	1XM	0.9054
726	CYT	0.9054
727	4SX	0.9053
728	OXE	0.9052
729	ASO	0.9051
730	E5X	0.9051
731	NDH	0.9050
732	CTL	0.9050
733	FUL	0.9047
734	5XC	0.9047
735	GLC	0.9047
736	2KT	0.9047
737	XSP	0.9046
738	QOS	0.9045
739	FUB	0.9044
740	DUC	0.9044
741	PBA	0.9043
742	PXL	0.9042
743	G6D	0.9042
744	M6N	0.9040
745	DHQ	0.9040
746	12Q	0.9040
747	RNS	0.9039
748	YH7	0.9038
749	I4B	0.9038
750	F81	0.9038
751	2HG	0.9037
752	IUR	0.9036
753	SKA	0.9036
754	NVA	0.9036
755	DIN	0.9035
756	BVF	0.9035
757	Q24	0.9034
758	MRW	0.9032
759	CSS	0.9032
760	LYL	0.9030
761	3MB	0.9030
762	XRG	0.9030
763	RIP	0.9027
764	3PG	0.9026
765	26D	0.9026
766	PRA	0.9025
767	AZ8	0.9024
768	2AS	0.9023
769	JIF	0.9023
770	YHO	0.9023
771	NSP	0.9023
772	4JO	0.9021
773	4MV	0.9021
774	9PO	0.9018
775	2HQ	0.9017
776	3Z8	0.9014
777	2BG	0.9014
778	DFU	0.9013
779	HQT	0.9013
780	FA1	0.9012
781	PIH	0.9011
782	ANN	0.9011
783	PNZ	0.9011
784	6GU	0.9010
785	E7Z	0.9010
786	ZZ3	0.9010
787	IVA	0.9009
788	GOJ	0.9007
789	HGW	0.9007
790	5GU	0.9004
791	2CH	0.9004
792	AMH	0.9003
793	64K	0.9003
794	H95	0.9003
795	ONL	0.9003
796	FOT	0.9002
797	IF7	0.9001
798	GIO	0.9000
799	86J	0.9000
800	449	0.8999
801	UNC	0.8999
802	0W8	0.8998
803	HJP	0.8997
804	FGZ	0.8997
805	DMJ	0.8996
806	32X	0.8996
807	4FH	0.8995
808	VNL	0.8992
809	2FY	0.8990
810	6RQ	0.8990
811	K7M	0.8989
812	DGY	0.8987
813	MS9	0.8987
814	NEQ	0.8987
815	FBT	0.8985
816	SWA	0.8985
817	MNM	0.8984
818	1GP	0.8984
819	MEW	0.8983
820	3AL	0.8983
821	92Z	0.8980
822	TLD	0.8979
823	SSN	0.8978
824	FUC	0.8977
825	3MC	0.8976
826	4YO	0.8976
827	PE0	0.8975
828	HIU	0.8975
829	KG7	0.8975
830	2FT	0.8973
831	8WO	0.8972
832	R9S	0.8971
833	C2U	0.8971
834	PGA	0.8970
835	LZM	0.8969
836	0MK	0.8969
837	23J	0.8968
838	IV2	0.8967
839	4P0	0.8966
840	47J	0.8966
841	TYL	0.8964
842	RNT	0.8963
843	BDP	0.8963
844	GLL	0.8962
845	92K	0.8962
846	HC4	0.8961
847	DBX	0.8960
848	3Z7	0.8960
849	HDA	0.8960
850	HPS	0.8958
851	M5K	0.8957
852	1AN	0.8956
853	4BZ	0.8955
854	SER	0.8954
855	GLY ALA	0.8954
856	HGQ	0.8954
857	MET	0.8953
858	G3F	0.8953
859	SC2	0.8953
860	ODO	0.8953
861	FP2	0.8951
862	N2Z	0.8951
863	KT7	0.8950
864	263	0.8950
865	OW4	0.8949
866	PYG	0.8948
867	IOL	0.8947
868	G2H	0.8947
869	5RN	0.8946
870	AQO	0.8945
871	OHP	0.8945
872	PAH	0.8944
873	S0H	0.8944
874	8ZE	0.8944
875	8LG	0.8943
876	FDB	0.8943
877	URC	0.8943
878	CEJ	0.8942
879	0HO	0.8942
880	MT0	0.8941
881	BNF	0.8941
882	CIG	0.8940
883	0JD	0.8940
884	BCP	0.8940
885	ORN	0.8939
886	HEW	0.8939
887	F5B	0.8937
888	9MG	0.8937
889	G5V	0.8936
890	RAM	0.8935
891	MQN	0.8935
892	4Z4	0.8933
893	82I	0.8933
894	KTA	0.8932
895	25T	0.8932
896	KBB	0.8932
897	MZB	0.8931
898	3QM	0.8931
899	JZ0	0.8930
900	2AF	0.8930
901	3IT	0.8929
902	IJZ	0.8928
903	2EC	0.8928
904	PGH	0.8928
905	SYG	0.8928
906	8S0	0.8927
907	XXR	0.8927
908	X1S	0.8926
909	3NY	0.8926
910	HHH	0.8923
911	HQJ	0.8923
912	4H2	0.8921
913	L89	0.8921
914	HYN	0.8921
915	DIU	0.8920
916	Q6T	0.8920
917	13P	0.8920
918	ABI	0.8919
919	ABU	0.8918
920	MED	0.8917
921	4JQ	0.8916
922	B57	0.8916
923	PAE	0.8916
924	EXO	0.8914
925	EYK	0.8914
926	BPN	0.8914
927	285	0.8914
928	GLN	0.8913
929	MWP	0.8913
930	2ZM	0.8912
931	495	0.8911
932	KJH	0.8911
933	GAL	0.8909
934	LRH	0.8908
935	R8S	0.8908
936	FLM	0.8907
937	Y8I	0.8906
938	OGA	0.8905
939	0TU	0.8904
940	KJU	0.8904
941	LGC	0.8902
942	KMT	0.8900
943	F9Y	0.8899
944	24T	0.8899
945	3V4	0.8898
946	6NT	0.8898
947	HZQ	0.8896
948	XQG	0.8894
949	O7U	0.8894
950	YAN	0.8893
951	F0J	0.8891
952	LLQ	0.8888
953	4ZC	0.8888
954	3PP	0.8887
955	SN4	0.8887
956	52C	0.8887
957	32O	0.8885
958	7EX	0.8885
959	76X	0.8885
960	F31	0.8885
961	CP	0.8885
962	APG	0.8882
963	A29	0.8879
964	5JQ	0.8877
965	B85	0.8875
966	SOE	0.8875
967	4VY	0.8874
968	M3T	0.8874
969	4HC	0.8873
970	AJ2	0.8873
971	HTS	0.8872
972	93Q	0.8872
973	GP9	0.8872
974	0HN	0.8872
975	TMZ	0.8871
976	2H5	0.8871
977	LEA	0.8871
978	NCT	0.8871
979	PZM	0.8870
980	AKH	0.8868
981	MAN	0.8868
982	ADA	0.8867
983	RJY	0.8866
984	QWW	0.8865
985	JBQ	0.8860
986	ABA	0.8860
987	2A9	0.8860
988	EDR	0.8860
989	AZ9	0.8859
990	FBU	0.8859
991	42C	0.8857
992	DSN	0.8856
993	B55	0.8856
994	BTY	0.8855
995	IPU	0.8855
996	B3R	0.8854
997	GGL	0.8853
998	938	0.8852
999	7MH	0.8852
1000	3WA	0.8852
1001	IPZ	0.8851
1002	MSR	0.8848
1003	RAT	0.8847
1004	BCU	0.8846
1005	L5V	0.8846
1006	0OC	0.8845
1007	CYS	0.8844
1008	MPD	0.8843
1009	2F6	0.8841
1010	J9W	0.8840
1011	7NI	0.8840
1012	H76	0.8838
1013	75K	0.8838
1014	1DH	0.8837
1015	ARA	0.8837
1016	ALL	0.8837
1017	GCS	0.8836
1018	GTR	0.8835
1019	QX2	0.8835
1020	6X8	0.8835
1021	2FG	0.8834
1022	E60	0.8830
1023	8TX	0.8829
1024	FPK	0.8829
1025	4XX	0.8829
1026	C2N	0.8828
1027	M2H	0.8828
1028	3FA	0.8826
1029	FFP	0.8824
1030	GMN	0.8823
1031	BEA	0.8823
1032	QBK	0.8821
1033	KBG	0.8821
1034	4HM	0.8821
1035	TGX	0.8819
1036	GCU	0.8818
1037	XAZ	0.8818
1038	EUG	0.8818
1039	4M4	0.8818
1040	WOO	0.8817
1041	FK8	0.8817
1042	2HU	0.8817
1043	ADK	0.8816
1044	3MA	0.8816
1045	XIX	0.8816
1046	MO8	0.8815
1047	DBB	0.8815
1048	42J	0.8815
1049	ICO	0.8815
1050	DGL	0.8814
1051	MJ2	0.8812
1052	GVG	0.8807
1053	V55	0.8807
1054	DBJ	0.8806
1055	FUF	0.8805
1056	8WT	0.8805
1057	HLZ	0.8803
1058	CPZ	0.8801
1059	EV0	0.8800
1060	1GN	0.8798
1061	CTS	0.8798
1062	OPE	0.8796
1063	5NI	0.8795
1064	1F1	0.8793
1065	BZ2	0.8793
1066	DXX	0.8792
1067	MUA	0.8792
1068	3HP	0.8792
1069	MBD	0.8791
1070	6LW	0.8790
1071	ACH	0.8790
1072	JFD	0.8788
1073	4XV	0.8785
1074	KJY	0.8785
1075	M2K	0.8785
1076	1XX	0.8784
1077	AJV	0.8784
1078	PHE	0.8783
1079	6MH	0.8782
1080	F4E	0.8781
1081	AS3	0.8780
1082	YTB	0.8779
1083	2MY	0.8779
1084	HQD	0.8778
1085	6NI	0.8777
1086	GOO	0.8776
1087	2C9	0.8776
1088	HHQ	0.8776
1089	M1H	0.8775
1090	TMT	0.8775
1091	DTU	0.8771
1092	DRL	0.8771
1093	1SP	0.8771
1094	PA1	0.8770
1095	GAF	0.8769
1096	3A9	0.8769
1097	5JL	0.8768
1098	SAT	0.8768
1099	M1Q	0.8767
1100	DEE	0.8766
1101	M1E	0.8763
1102	7VS	0.8761
1103	B53	0.8761
1104	RUY	0.8761
1105	HXX	0.8761
1106	8IG	0.8759
1107	M0Q	0.8759
1108	X6X	0.8758
1109	JAW	0.8756
1110	4SD	0.8756
1111	QIC	0.8755
1112	6OT	0.8752
1113	6UA	0.8752
1114	BDF	0.8751
1115	6TZ	0.8751
1116	M0W	0.8745
1117	TZF	0.8744
1118	LSA	0.8743
1119	N2I	0.8742
1120	3CE	0.8742
1121	PMF	0.8742
1122	T6C	0.8741
1123	GXL	0.8740
1124	GXY	0.8735
1125	329	0.8735
1126	3RK	0.8735
1127	TM4	0.8734
1128	7VD	0.8734
1129	INS	0.8731
1130	WDL	0.8730
1131	3MH	0.8727
1132	5RO	0.8727
1133	3DM	0.8726
1134	TB6	0.8726
1135	39A	0.8725
1136	NK2	0.8722
1137	SNU	0.8720
1138	ODV	0.8720
1139	J9N	0.8717
1140	12M	0.8716
1141	15E	0.8715
1142	UFV	0.8712
1143	13X	0.8711
1144	TAG	0.8711
1145	GIV	0.8705
1146	R67	0.8705
1147	0N7	0.8705
1148	4HP	0.8703
1149	DUB	0.8702
1150	4XS	0.8701
1151	CXP	0.8700
1152	149	0.8697
1153	3R6	0.8694
1154	RM4	0.8694
1155	IWT	0.8694
1156	1SH	0.8692
1157	AX2	0.8691
1158	FDK	0.8691
1159	2CM	0.8691
1160	6ME	0.8690
1161	DQY	0.8688
1162	ESP	0.8687
1163	APZ	0.8685
1164	9FL	0.8685
1165	7VP	0.8683
1166	B62	0.8681
1167	DIE	0.8679
1168	5ZE	0.8678
1169	3AY	0.8677
1170	PRZ	0.8674
1171	5AN	0.8673
1172	ICB	0.8673
1173	5WX	0.8672
1174	JF6	0.8671
1175	9X6	0.8668
1176	BR8	0.8668
1177	Z5P	0.8668
1178	0BP	0.8668
1179	6FZ	0.8663
1180	R20	0.8660
1181	2AK	0.8658
1182	M45	0.8657
1183	XXG	0.8656
1184	JND	0.8656
1185	BMA	0.8655
1186	GOL	0.8655
1187	2ZX	0.8653
1188	MBG	0.8646
1189	Q02	0.8645
1190	OTW	0.8643
1191	TSS	0.8640
1192	260	0.8639
1193	36Y	0.8628
1194	DQU	0.8628
1195	XXP	0.8625
1196	FA3	0.8624
1197	HCI	0.8624
1198	2CL	0.8624
1199	LYS	0.8621
1200	4ME	0.8620
1201	FUD	0.8620
1202	OMD	0.8615
1203	6HQ	0.8614
1204	JDN	0.8613
1205	KDV	0.8612
1206	44V	0.8609
1207	N8Y	0.8607
1208	0FO	0.8604
1209	XHP	0.8602
1210	ISE	0.8601
1211	SME	0.8601
1212	NQ	0.8600
1213	192	0.8600
1214	KMH	0.8597
1215	N3W	0.8595
1216	F12	0.8593
1217	PPV	0.8592
1218	PEZ	0.8591
1219	EVA	0.8590
1220	4MU	0.8590
1221	MPV	0.8590
1222	VK3	0.8588
1223	9CA	0.8585
1224	EGD	0.8584
1225	0F9	0.8584
1226	BNL	0.8583
1227	1IT	0.8580
1228	TEP	0.8580
1229	1WC	0.8578
1230	TTY	0.8578
1231	SAR	0.8570
1232	1CB	0.8561
1233	37T	0.8557
1234	YSO	0.8552
1235	RXA	0.8549
1236	TBP	0.8548
1237	M4S	0.8548
1238	4MZ	0.8528
1239	FCN	0.8525
1240	DHY	0.8523
1241	PRF	0.8522
1242	1U6	0.8521
1243	KSW	0.8515

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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