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Receptor

PDB id	Resolution	Class	Description	Source	Keywords
3MBM	1.8 Å	EC: 4.6.1.12	CRYSTAL STRUCTURE OF 2C-METHYL-D-ERYTHRITOL 2,4-CYCLODIPHOSP SYNTHASE FROM BURKHOLDERIA PSEUDOMALLEI WITH CYTOSINE AND FF RAGMENT 717, IMIDAZO[2,1-B][1,3]THIAZOL-6-YLMETHANOL	BURKHOLDERIA PSEUDOMALLEI	NIAID SEATTLE STRUCTURAL GENOMICS CENTER FOR INFECTIOUS DISSSGCID ISPF CYTOSINE MEP PATHWAY FRAGMENT-BASED DRUG DEFBDD FRAGMENTS OF LIFE ISOPRENE BIOSYNTHESIS LYASE META
Ref.:	LEVERAGING STRUCTURE DETERMINATION WITH FRAGMENT SC FOR INFECTIOUS DISEASE DRUG TARGETS: MECP SYNTHASE BURKHOLDERIA PSEUDOMALLEI. J STRUCT FUNCT GENOMICS V. 12 63 2011

Ligand

Ligand	Chain:Residue	Validity	Ligand Warnings	Binding Data	Molecular Weight (Da)	Formula	SMILES
717	A:165; B:165; C:163;	Valid; Valid; Valid;	none; none; none;	submit data	154.19	C6 H6 N2 O S	c1csc...
CYT	A:164; B:164; C:165;	Valid; Valid; Valid;	none; none; none;	submit data	111.102	C4 H5 N3 O	C1=C(...
TRS	A:166;	Invalid;	none;	submit data	122.143	C4 H12 N O3	C(C(C...
ZN	A:163; B:163; C:164;	Part of Protein; Part of Protein; Part of Protein;	none; none; none;	submit data	65.409	Zn	[Zn+2...

View in 3D viewer

90% Homology Family

Leader

PDB id	Resolution	Class	Description	Source	Keywords
3JVH	1.69 Å	EC: 4.6.1.12	CRYSTAL STRUCTURE OF 2C-METHYL-D-ERYTHRITOL-2,4-CYCLODIPHOSP SYNTHASE FROM BURKHOLDERIA PSEUDOMALLEI WITH FOL FRAGMENT 8	BURKHOLDERIA PSEUDOMALLEI	NIAID SSGCID SEATTLE DTRUCTURAL GENOMICS CENTER FOR INFECTDISEASE FRAGMENT CRYSTALLOGRAPHY FRAGMENTS OF LIFE ZINC-FRAGMENT ISOPRENE BIOSYNTHESIS LYASE METAL-BINDING STRUGENOMICS SEATTLE STRUCTURAL GENOMICS CENTER FOR INFECTIOUS
Ref.:	LEVERAGING STRUCTURE DETERMINATION WITH FRAGMENT SC FOR INFECTIOUS DISEASE DRUG TARGETS: MECP SYNTHASE BURKHOLDERIA PSEUDOMALLEI. J STRUCT FUNCT GENOMICS V. 12 63 2011

Members (12)

No:	PDB id	Binding Data	Representative ligand	Formula	Smiles
The Class containing this family consists of a total of 8 families.
1	3IEW	-	CTP	C9 H16 N3 O14 P3	C1=CN(C(=O....
2	3QHD	-	CTN	C9 H13 N3 O5	C1=CN(C(=O....
3	3K2X	-	I5A	C9 H12 I N3 O4	C1=CN(C(=O....
4	3F0G	-	C5P	C9 H14 N3 O8 P	C1=CN(C(=O....
5	3IKE	-	CYT	C4 H5 N3 O	C1=C(NC(=O....
6	3IEQ	-	C	C9 H14 N3 O8 P	C1=CN(C(=O....
7	3IKF	-	717	C6 H6 N2 O S	c1csc2n1cc....
8	3JVH	-	HHV	C10 H11 N5 O	c1cc(cnc1)....
9	3P10	-	CTN	C9 H13 N3 O5	C1=CN(C(=O....
10	3MBM	-	CYT	C4 H5 N3 O	C1=C(NC(=O....
11	3P0Z	-	CTN	C9 H13 N3 O5	C1=CN(C(=O....
12	3K14	-	535	C9 H10 N2 O2 S	CCOC(=O)c1....

70% Homology Family (20)

No:	PDB id	Binding Data	Representative ligand	Formula	Smiles
The Class containing this family consists of a total of 6 families.
1	1T0A	-	FPP	C15 H28 O7 P2	CC(=CCC/C(....
2	4C8G	-	C5P	C9 H14 N3 O8 P	C1=CN(C(=O....
3	4C8E	-	C5P	C9 H14 N3 O8 P	C1=CN(C(=O....
4	3ERN	Kd = 18.91 mM	CAR	C9 H14 N3 O8 P	C1=CN(C(=O....
5	2GZL	Kd = 15 uM	2AA	C23 H31 N5 O13 P2 S	CN(C)c1ccc....
6	3ELC	Kd = 2.02 mM	F01	C9 H12 F N3 O5	C1=C(C(=NC....
7	1JY8	-	CDI	C5 H12 O9 P2	C[C@@]1([C....
8	1GX1	-	CDP	C9 H15 N3 O11 P2	C1=CN(C(=O....
9	1U3L	-	CDP	C9 H15 N3 O11 P2	C1=CN(C(=O....
10	1H47	-	GPP	C10 H20 O7 P2	CC(=CCC/C(....
11	1H48	-	CDI	C5 H12 O9 P2	C[C@@]1([C....
12	2AMT	Kd = 36 uM	1AA	C18 H24 N4 O13 P2	c1ccc(c(c1....
13	3IKE	-	CYT	C4 H5 N3 O	C1=C(NC(=O....
14	3IEQ	-	C	C9 H14 N3 O8 P	C1=CN(C(=O....
15	3IKF	-	717	C6 H6 N2 O S	c1csc2n1cc....
16	3JVH	-	HHV	C10 H11 N5 O	c1cc(cnc1)....
17	3P10	-	CTN	C9 H13 N3 O5	C1=CN(C(=O....
18	3MBM	-	CYT	C4 H5 N3 O	C1=C(NC(=O....
19	3P0Z	-	CTN	C9 H13 N3 O5	C1=CN(C(=O....
20	3K14	-	535	C9 H10 N2 O2 S	CCOC(=O)c1....

50% Homology Family (28)

No:	PDB id	Binding Data	Representative ligand	Formula	Smiles
The Class containing this family consists of a total of 3 families.
1	1T0A	-	FPP	C15 H28 O7 P2	CC(=CCC/C(....
2	4C8I	-	CIT	C6 H8 O7	C(C(=O)O)C....
3	4C8G	-	C5P	C9 H14 N3 O8 P	C1=CN(C(=O....
4	4C8E	-	C5P	C9 H14 N3 O8 P	C1=CN(C(=O....
5	3ERN	Kd = 18.91 mM	CAR	C9 H14 N3 O8 P	C1=CN(C(=O....
6	2GZL	Kd = 15 uM	2AA	C23 H31 N5 O13 P2 S	CN(C)c1ccc....
7	3ELC	Kd = 2.02 mM	F01	C9 H12 F N3 O5	C1=C(C(=NC....
8	1JY8	-	CDI	C5 H12 O9 P2	C[C@@]1([C....
9	1GX1	-	CDP	C9 H15 N3 O11 P2	C1=CN(C(=O....
10	1U3L	-	CDP	C9 H15 N3 O11 P2	C1=CN(C(=O....
11	1H47	-	GPP	C10 H20 O7 P2	CC(=CCC/C(....
12	1H48	-	CDI	C5 H12 O9 P2	C[C@@]1([C....
13	2AMT	Kd = 36 uM	1AA	C18 H24 N4 O13 P2	c1ccc(c(c1....
14	3IEW	-	CTP	C9 H16 N3 O14 P3	C1=CN(C(=O....
15	3QHD	-	CTN	C9 H13 N3 O5	C1=CN(C(=O....
16	3K2X	-	I5A	C9 H12 I N3 O4	C1=CN(C(=O....
17	3F0G	-	C5P	C9 H14 N3 O8 P	C1=CN(C(=O....
18	3IKE	-	CYT	C4 H5 N3 O	C1=C(NC(=O....
19	3IEQ	-	C	C9 H14 N3 O8 P	C1=CN(C(=O....
20	3IKF	-	717	C6 H6 N2 O S	c1csc2n1cc....
21	3JVH	-	HHV	C10 H11 N5 O	c1cc(cnc1)....
22	3P10	-	CTN	C9 H13 N3 O5	C1=CN(C(=O....
23	3MBM	-	CYT	C4 H5 N3 O	C1=C(NC(=O....
24	3P0Z	-	CTN	C9 H13 N3 O5	C1=CN(C(=O....
25	3K14	-	535	C9 H10 N2 O2 S	CCOC(=O)c1....
26	1IV4	-	C5P	C9 H14 N3 O8 P	C1=CN(C(=O....
27	2PMP	-	C5P	C9 H14 N3 O8 P	C1=CN(C(=O....
28	2UZH	-	CDP	C9 H15 N3 O11 P2	C1=CN(C(=O....

Polypharmacology

Similar Ligands (2D)

Ligand no: 1; Ligand: 717; Similar ligands found: 1

No:	Ligand	ECFP6 Tc	MDL keys Tc
1	717	1	1

Ligand no: 2; Ligand: CYT; Similar ligands found: 1

No:	Ligand	ECFP6 Tc	MDL keys Tc
1	CYT	1	1

Similar Ligands (3D)

Ligand no: 1; Ligand: 717; Similar ligands found: 1268

No:	Ligand	Similarity coefficient
1	XIY	0.9823
2	KOJ	0.9766
3	2BG	0.9763
4	1M2	0.9745
5	HBA	0.9725
6	MR1	0.9718
7	4P5	0.9703
8	2MI	0.9695
9	FBA	0.9667
10	AX7	0.9661
11	270	0.9661
12	P92	0.9656
13	ABV	0.9655
14	4FA	0.9652
15	BZ3	0.9635
16	PHB	0.9632
17	NPO	0.9629
18	5XC	0.9624
19	BSX	0.9622
20	5OB	0.9616
21	HY1	0.9613
22	PAB	0.9612
23	4WL	0.9602
24	BHO	0.9598
25	XM0	0.9591
26	AEF	0.9578
27	4VP	0.9576
28	5MI	0.9574
29	4ZA	0.9574
30	JAE	0.9573
31	11S	0.9573
32	PZM	0.9572
33	YRL	0.9572
34	C2B	0.9571
35	4JM	0.9570
36	F9Y	0.9568
37	BZX	0.9556
38	ISZ	0.9553
39	ES9	0.9551
40	5H1	0.9546
41	CXF	0.9546
42	14O	0.9545
43	F60	0.9541
44	4JL	0.9540
45	H4N	0.9539
46	Z82	0.9539
47	6AI	0.9535
48	268	0.9535
49	FK1	0.9534
50	JB5	0.9532
51	5MB	0.9532
52	03V	0.9528
53	4FS	0.9528
54	2K4	0.9524
55	GJZ	0.9524
56	ES5	0.9519
57	H42	0.9516
58	HMH	0.9516
59	2AQ	0.9514
60	COU	0.9510
61	FEH	0.9507
62	P72	0.9507
63	I3A	0.9507
64	H8N	0.9505
65	ET2	0.9504
66	NIZ	0.9503
67	CFI	0.9497
68	FAN	0.9495
69	TH7	0.9493
70	8ZE	0.9492
71	BZ2	0.9491
72	DHR	0.9488
73	LDP	0.9488
74	ESP	0.9487
75	HBD	0.9486
76	BCU	0.9484
77	BPN	0.9483
78	FP1	0.9481
79	PNZ	0.9480
80	AHR	0.9474
81	PBZ	0.9474
82	F9P	0.9461
83	1F1	0.9461
84	8NY	0.9461
85	JZ7	0.9460
86	DE5	0.9459
87	N2I	0.9458
88	6FZ	0.9455
89	OCH	0.9453
90	1P8	0.9453
91	826	0.9452
92	4MA	0.9452
93	FBM	0.9450
94	1DW	0.9449
95	1Y6	0.9448
96	E5X	0.9448
97	NYL	0.9448
98	RSO	0.9446
99	4XR	0.9445
100	HDH	0.9445
101	I1E	0.9441
102	SYV	0.9438
103	4BZ	0.9436
104	0HN	0.9434
105	FYU	0.9433
106	ICB	0.9433
107	PEL	0.9432
108	INO	0.9432
109	258	0.9431
110	3A9	0.9431
111	AMH	0.9430
112	K2T	0.9427
113	OAA	0.9427
114	259	0.9427
115	264	0.9426
116	4JT	0.9422
117	DHB	0.9422
118	BNF	0.9422
119	4NM	0.9421
120	174	0.9420
121	FBB	0.9418
122	FQI	0.9416
123	5NI	0.9412
124	24B	0.9411
125	CLW	0.9410
126	P9P	0.9410
127	XQ0	0.9408
128	RM1	0.9405
129	PZI	0.9402
130	PHU	0.9401
131	2ZM	0.9400
132	RBJ	0.9399
133	ES2	0.9397
134	BEN	0.9397
135	6NT	0.9396
136	M6W	0.9395
137	5WV	0.9394
138	8WT	0.9393
139	AMC	0.9391
140	R8S	0.9390
141	Q88	0.9389
142	NF3	0.9389
143	1PT	0.9386
144	5VM	0.9385
145	AC6	0.9382
146	36R	0.9382
147	ISN	0.9380
148	TPA	0.9377
149	PEA	0.9377
150	ANN	0.9376
151	VGD	0.9374
152	QY9	0.9371
153	ABI	0.9371
154	M4T	0.9371
155	CWM	0.9369
156	NSP	0.9369
157	0HO	0.9369
158	GLC	0.9361
159	OTR	0.9359
160	XRG	0.9358
161	SYN	0.9356
162	NNO	0.9355
163	14J	0.9355
164	9TW	0.9354
165	HX3	0.9354
166	PBC	0.9353
167	SN4	0.9351
168	TYL	0.9345
169	BEZ	0.9345
170	IFL	0.9344
171	PAC	0.9344
172	3XX	0.9344
173	3NY	0.9343
174	AC0	0.9340
175	RBL	0.9339
176	261	0.9338
177	HSM	0.9337
178	SHA	0.9334
179	ZZT	0.9333
180	DIN	0.9333
181	FBJ	0.9330
182	2LP	0.9328
183	271	0.9327
184	BAM	0.9327
185	HMU	0.9326
186	A7W	0.9323
187	KDV	0.9323
188	7HQ	0.9321
189	ASO	0.9321
190	FHB	0.9320
191	DOB	0.9320
192	3ID	0.9319
193	ESX	0.9315
194	7W4	0.9309
195	BML	0.9309
196	ABN	0.9308
197	173	0.9307
198	SW7	0.9306
199	2HO	0.9306
200	HBX	0.9304
201	2A9	0.9303
202	42J	0.9303
203	4NC	0.9301
204	93K	0.9301
205	49F	0.9300
206	MLT	0.9300
207	NIO	0.9298
208	8H8	0.9298
209	XBT	0.9296
210	CTL	0.9296
211	JAW	0.9294
212	9CL	0.9292
213	JND	0.9290
214	GOJ	0.9289
215	QSB	0.9288
216	NCA	0.9287
217	J6W	0.9287
218	ES0	0.9286
219	6RQ	0.9286
220	3HM	0.9284
221	XX2	0.9284
222	FA0	0.9284
223	0JD	0.9284
224	OHG	0.9284
225	HIO	0.9283
226	IHB	0.9283
227	JA8	0.9282
228	OK7	0.9282
229	GAL	0.9281
230	2HU	0.9281
231	4A3	0.9280
232	NBZ	0.9280
233	BHA	0.9279
234	KKN	0.9279
235	JFJ	0.9278
236	BP9	0.9277
237	F4E	0.9277
238	ES7	0.9275
239	5NU	0.9275
240	DGJ	0.9275
241	069	0.9275
242	5CU	0.9275
243	CHB	0.9275
244	JLZ	0.9274
245	1P7	0.9273
246	UNU	0.9273
247	CEE	0.9273
248	TZL	0.9270
249	ZBT	0.9270
250	6NI	0.9270
251	PBA	0.9269
252	7WG	0.9267
253	DMD	0.9266
254	4M0	0.9266
255	JB8	0.9266
256	DHS	0.9265
257	MYJ	0.9264
258	4JQ	0.9261
259	URO	0.9260
260	MUC	0.9259
261	PKU	0.9259
262	6PC	0.9259
263	QUZ	0.9258
264	L99	0.9258
265	PZA	0.9257
266	URS	0.9255
267	4JU	0.9255
268	JDN	0.9254
269	LYL	0.9253
270	PYF	0.9252
271	69O	0.9252
272	4CH	0.9252
273	MET	0.9249
274	EUG	0.9248
275	AEG	0.9246
276	4HM	0.9245
277	1LN	0.9245
278	MXN	0.9244
279	NPY	0.9244
280	LMR	0.9243
281	M3H	0.9242
282	PIY	0.9242
283	7MU	0.9242
284	PYJ	0.9241
285	DFB	0.9241
286	45L	0.9240
287	ILE	0.9239
288	5LA	0.9239
289	428	0.9238
290	LNR	0.9236
291	K34	0.9232
292	5B1	0.9231
293	FPI	0.9231
294	NOY	0.9229
295	2FY	0.9228
296	G2F	0.9228
297	3OC	0.9227
298	PO6	0.9226
299	FA1	0.9226
300	7N0	0.9225
301	SRT	0.9224
302	TIU	0.9223
303	J9N	0.9222
304	82I	0.9221
305	PIM	0.9216
306	2D0	0.9212
307	TH0	0.9212
308	LCN	0.9212
309	B24	0.9212
310	JZ5	0.9210
311	GLN	0.9209
312	NOJ	0.9208
313	3AL	0.9207
314	2AL	0.9207
315	2CK	0.9207
316	IF7	0.9206
317	KTA	0.9205
318	UY7	0.9201
319	KJU	0.9200
320	DYA	0.9199
321	LDU	0.9198
322	IXW	0.9198
323	MRW	0.9198
324	MNN	0.9196
325	1MR	0.9196
326	IPB	0.9193
327	XYL	0.9191
328	RB5	0.9191
329	NBE	0.9188
330	53C	0.9187
331	CN0	0.9187
332	ZXD	0.9186
333	0R0	0.9184
334	5FX	0.9184
335	GAB	0.9184
336	1DJ	0.9183
337	OKG	0.9182
338	MQN	0.9182
339	APY	0.9182
340	67N	0.9181
341	M1A	0.9180
342	9FL	0.9180
343	DEN	0.9177
344	IDM	0.9177
345	RNT	0.9174
346	ODO	0.9174
347	NTN	0.9173
348	JZ4	0.9173
349	282	0.9172
350	YCP	0.9172
351	S8V	0.9171
352	TSS	0.9171
353	6M9	0.9170
354	BNS	0.9170
355	QSC	0.9169
356	E7S	0.9169
357	IFM	0.9168
358	WCE	0.9168
359	RNS	0.9168
360	J9Q	0.9167
361	KMT	0.9167
362	TSU	0.9167
363	XUL	0.9166
364	6M4	0.9166
365	URF	0.9166
366	3NT	0.9166
367	BE7	0.9165
368	PRY	0.9165
369	8WO	0.9164
370	NK	0.9162
371	M58	0.9162
372	EHM	0.9161
373	CWJ	0.9161
374	2MH	0.9160
375	4CL	0.9158
376	47J	0.9158
377	PY7	0.9158
378	5GU	0.9157
379	FCR	0.9157
380	36E	0.9156
381	2HQ	0.9156
382	BR9	0.9156
383	S2G	0.9155
384	AKG	0.9154
385	4M4	0.9154
386	SAN	0.9153
387	SAL	0.9153
388	XAN	0.9152
389	4HO	0.9151
390	HH5	0.9151
391	2AC	0.9150
392	VGL	0.9150
393	EDG	0.9150
394	9ZE	0.9150
395	V55	0.9149
396	AGK	0.9148
397	SS1	0.9146
398	OXZ	0.9144
399	DBH	0.9144
400	JZ2	0.9143
401	7W1	0.9143
402	LZ1	0.9143
403	2EC	0.9143
404	AL0	0.9143
405	4JJ	0.9142
406	0P6	0.9142
407	3HB	0.9141
408	WBU	0.9141
409	VNJ	0.9140
410	MCT	0.9138
411	XBZ	0.9138
412	42A	0.9138
413	ASP	0.9138
414	PRA	0.9136
415	XYP	0.9135
416	MWJ	0.9134
417	OGA	0.9134
418	9X7	0.9133
419	275	0.9132
420	ASC	0.9132
421	4YO	0.9132
422	BDP	0.9132
423	HSE	0.9131
424	DHK	0.9131
425	6AP	0.9130
426	R9Y	0.9130
427	JZ3	0.9129
428	BZI	0.9127
429	5QY	0.9127
430	6GU	0.9127
431	F0J	0.9126
432	27Y	0.9126
433	4J8	0.9126
434	RIB	0.9126
435	5QX	0.9125
436	9R5	0.9125
437	PXY	0.9125
438	H7Y	0.9125
439	MZW	0.9125
440	KT7	0.9124
441	286	0.9124
442	3U4	0.9123
443	94W	0.9123
444	RNO	0.9122
445	0RW	0.9122
446	NDH	0.9121
447	0R1	0.9121
448	86J	0.9121
449	F05	0.9121
450	FBS	0.9120
451	3HA	0.9120
452	MS9	0.9120
453	AHB	0.9120
454	SNO	0.9120
455	1DV	0.9120
456	MSR	0.9120
457	15N	0.9119
458	3C4	0.9119
459	IND	0.9118
460	4ZE	0.9118
461	4JN	0.9118
462	2XX	0.9117
463	HSO	0.9116
464	C2A	0.9115
465	4HS	0.9113
466	XYD	0.9112
467	JZ9	0.9111
468	J9T	0.9111
469	23A	0.9110
470	DIE	0.9110
471	5RN	0.9109
472	ICP	0.9108
473	PYD	0.9108
474	KJH	0.9107
475	LG4	0.9107
476	4AA	0.9107
477	BE2	0.9106
478	1MC	0.9104
479	MPI	0.9104
480	4XV	0.9103
481	9EW	0.9103
482	0TU	0.9103
483	3DM	0.9103
484	25R	0.9102
485	FK8	0.9102
486	HLR	0.9101
487	4SX	0.9101
488	9YL	0.9100
489	5JC	0.9100
490	GLU	0.9099
491	GGL	0.9099
492	CWS	0.9099
493	2IT	0.9099
494	QMP	0.9099
495	URC	0.9099
496	G4D	0.9098
497	LZM	0.9098
498	4FH	0.9098
499	D48	0.9097
500	MNM	0.9097
501	TDR	0.9096
502	DX4	0.9096
503	TTL	0.9095
504	BCP	0.9095
505	R9S	0.9095
506	12Q	0.9093
507	K97	0.9093
508	GTQ	0.9093
509	97T	0.9092
510	2FT	0.9091
511	PCR	0.9091
512	IOL	0.9091
513	QWN	0.9088
514	3AB	0.9088
515	NCT	0.9088
516	4CS	0.9088
517	ORN	0.9088
518	2CO	0.9087
519	UNJ	0.9086
520	9DG	0.9086
521	HQT	0.9085
522	ESI	0.9085
523	3Z8	0.9085
524	GZL	0.9084
525	XLS	0.9084
526	HCS	0.9083
527	SE2	0.9083
528	THE	0.9082
529	GVH	0.9082
530	OVV	0.9082
531	8OZ	0.9081
532	3DO	0.9081
533	LQ2	0.9081
534	HQE	0.9080
535	5HN	0.9080
536	MZG	0.9080
537	AAS	0.9079
538	34A	0.9077
539	YPN	0.9076
540	E1T	0.9076
541	3ZB	0.9076
542	3PF	0.9075
543	0FN	0.9075
544	ICO	0.9075
545	BZF	0.9074
546	AMS	0.9074
547	G3E	0.9073
548	DA1	0.9073
549	TLA	0.9072
550	MWM	0.9071
551	9CA	0.9071
552	J9W	0.9069
553	X0V	0.9068
554	GIF	0.9067
555	SS2	0.9067
556	ARW	0.9066
557	4BY	0.9066
558	HPS	0.9065
559	PCA	0.9065
560	FPN	0.9062
561	QSH	0.9062
562	5JL	0.9061
563	R8A	0.9061
564	2YU	0.9061
565	EA1	0.9060
566	AFR	0.9060
567	EOL	0.9060
568	GLL	0.9060
569	GDE	0.9059
570	EVF	0.9059
571	IDH	0.9058
572	2MP	0.9057
573	LXC	0.9057
574	6KT	0.9057
575	KUF	0.9056
576	VNL	0.9056
577	P3K	0.9054
578	J5I	0.9054
579	RHU	0.9054
580	KTW	0.9053
581	0CT	0.9052
582	8GC	0.9051
583	5MH	0.9050
584	AZA	0.9050
585	EKZ	0.9050
586	GUN	0.9050
587	4JP	0.9049
588	IFP	0.9049
589	4XS	0.9049
590	LT2	0.9048
591	4BL	0.9048
592	PLQ	0.9047
593	MAJ	0.9047
594	MAE	0.9047
595	SKA	0.9046
596	BTY	0.9045
597	N2Z	0.9045
598	SWA	0.9044
599	DMJ	0.9043
600	1AB	0.9042
601	ES6	0.9038
602	BGC	0.9038
603	IV2	0.9037
604	HQJ	0.9036
605	FPY	0.9036
606	GXL	0.9034
607	A1U	0.9033
608	R2B	0.9033
609	4NB	0.9033
610	AES	0.9033
611	VKC	0.9032
612	PRO	0.9032
613	4HP	0.9032
614	CFP	0.9031
615	3HG	0.9030
616	QXW	0.9030
617	6LW	0.9030
618	JZ1	0.9030
619	1IT	0.9029
620	0LH	0.9029
621	40E	0.9029
622	N8Y	0.9029
623	GLA	0.9028
624	4SD	0.9028
625	IWT	0.9028
626	SVN	0.9026
627	0BP	0.9026
628	Z6J	0.9025
629	FE DB1	0.9023
630	R8V	0.9022
631	PGH	0.9022
632	5RO	0.9022
633	CPZ	0.9022
634	4HC	0.9021
635	PRS	0.9020
636	F81	0.9019
637	NFM	0.9019
638	5UC	0.9018
639	F31	0.9018
640	SLS	0.9016
641	2HC	0.9016
642	449	0.9016
643	3MB	0.9015
644	FUL	0.9014
645	OVM	0.9013
646	HDA	0.9011
647	8CM	0.9010
648	M1Q	0.9010
649	HT4	0.9009
650	3M0	0.9009
651	8S0	0.9009
652	M5K	0.9008
653	R20	0.9008
654	HIS	0.9008
655	Y8I	0.9007
656	DHI	0.9007
657	43M	0.9007
658	3F0	0.9006
659	DS0	0.9006
660	RAT	0.9005
661	GAF	0.9004
662	9RW	0.9003
663	I4B	0.9003
664	13P	0.9002
665	ADZ	0.9002
666	5JQ	0.9002
667	L3Q	0.9001
668	L14	0.9001
669	K7M	0.9001
670	FGZ	0.8998
671	X6X	0.8998
672	0W1	0.8998
673	DEE	0.8998
674	2HG	0.8997
675	RMN	0.8997
676	SOE	0.8997
677	AEH	0.8996
678	JBK	0.8995
679	SPA	0.8995
680	7WV	0.8994
681	PHE	0.8994
682	TAG	0.8993
683	COI	0.8992
684	XAZ	0.8992
685	M2K	0.8991
686	92K	0.8991
687	TM7	0.8990
688	1DU	0.8990
689	DHY	0.8990
690	Q24	0.8988
691	SKM	0.8988
692	JBE	0.8988
693	QOS	0.8988
694	SAF	0.8988
695	4VY	0.8987
696	FOC	0.8987
697	PMB	0.8987
698	DGN	0.8986
699	2AS	0.8985
700	GO2	0.8985
701	FB2	0.8984
702	BRT	0.8983
703	MEV	0.8983
704	1CO	0.8983
705	RIP	0.8982
706	GUA	0.8982
707	4SV	0.8981
708	9FE	0.8981
709	GRO	0.8981
710	GIV	0.8980
711	3R6	0.8978
712	IT2	0.8978
713	SMN	0.8976
714	0MK	0.8976
715	A7N	0.8975
716	YH7	0.8974
717	B57	0.8974
718	3BZ	0.8974
719	LPK	0.8973
720	AX3	0.8972
721	0CU	0.8970
722	7VP	0.8969
723	2RH	0.8969
724	HHH	0.8969
725	TAR	0.8968
726	3SL	0.8967
727	MRY	0.8967
728	I3E	0.8967
729	SSB	0.8966
730	8TX	0.8965
731	2PC	0.8965
732	AZF	0.8964
733	23W	0.8964
734	1XM	0.8962
735	5WZ	0.8962
736	75K	0.8962
737	G3F	0.8961
738	GLY ALA	0.8960
739	E7Z	0.8960
740	1SA	0.8960
741	TP5	0.8959
742	SJ5	0.8959
743	TCA	0.8959
744	JKE	0.8959
745	MRZ	0.8958
746	FDB	0.8958
747	5SG	0.8957
748	A2F	0.8957
749	ASN	0.8957
750	2BX	0.8957
751	ES1	0.8955
752	51F	0.8955
753	1L5	0.8955
754	5IQ	0.8954
755	7B4	0.8954
756	J1Z	0.8953
757	TGX	0.8953
758	NLE	0.8953
759	4ZC	0.8952
760	GYE	0.8952
761	OHP	0.8952
762	HYP	0.8952
763	12T	0.8952
764	5MK	0.8951
765	AZ8	0.8950
766	1LQ	0.8949
767	1SQ	0.8948
768	6VD	0.8948
769	RSF	0.8948
770	GLF	0.8947
771	HC4	0.8947
772	TZF	0.8945
773	SD4	0.8945
774	ORO	0.8944
775	SRO	0.8944
776	HPA	0.8944
777	BEA	0.8943
778	URQ	0.8943
779	IAC	0.8942
780	HX4	0.8942
781	4JO	0.8941
782	L5V	0.8938
783	TEO	0.8938
784	SVD	0.8936
785	A5E	0.8936
786	OW4	0.8934
787	5RG	0.8934
788	FUD	0.8934
789	M45	0.8934
790	1P3	0.8933
791	5Q0	0.8933
792	A29	0.8932
793	GWM	0.8932
794	MAH	0.8932
795	FRU	0.8930
796	263	0.8930
797	G3P	0.8930
798	G3H	0.8930
799	5XB	0.8930
800	54G	0.8929
801	N5J	0.8929
802	SNU	0.8929
803	PPY	0.8929
804	NMJ	0.8928
805	H3M	0.8928
806	PE0	0.8927
807	M4S	0.8927
808	BDF	0.8926
809	B85	0.8926
810	4YS	0.8925
811	VOH	0.8925
812	AJ2	0.8925
813	SEP	0.8924
814	C21	0.8923
815	HHA	0.8923
816	JPZ	0.8923
817	TIH	0.8922
818	2FG	0.8922
819	SR1	0.8921
820	SIN	0.8921
821	MEW	0.8920
822	BNL	0.8920
823	DTU	0.8919
824	HL5	0.8919
825	4Z4	0.8919
826	FUC	0.8919
827	LT1	0.8918
828	5M0	0.8917
829	GJP	0.8917
830	HA5	0.8916
831	AQO	0.8916
832	TZC	0.8916
833	FUM	0.8916
834	WOO	0.8915
835	XIZ	0.8915
836	HQY	0.8913
837	36Y	0.8912
838	XQG	0.8911
839	M2H	0.8911
840	51R	0.8911
841	KMH	0.8910
842	JYD	0.8910
843	SHO	0.8909
844	PA1	0.8908
845	B55	0.8905
846	C1M	0.8905
847	52C	0.8905
848	149	0.8905
849	BPW	0.8904
850	PYC	0.8903
851	GCU	0.8903
852	B40	0.8903
853	PD2	0.8903
854	4XH	0.8902
855	1WD	0.8902
856	HHI	0.8902
857	IUR	0.8901
858	FOA	0.8900
859	TLD	0.8900
860	PXL	0.8900
861	MAN	0.8900
862	TZE	0.8899
863	SX1	0.8899
864	DFU	0.8898
865	OW7	0.8898
866	EV0	0.8897
867	3SK	0.8894
868	6N4	0.8894
869	24W	0.8894
870	AZG	0.8891
871	LEU	0.8890
872	3BU	0.8890
873	27B	0.8889
874	MWP	0.8888
875	3HP	0.8886
876	M1E	0.8885
877	XYS	0.8885
878	EYV	0.8883
879	TT4	0.8883
880	FBW	0.8882
881	IP0	0.8882
882	GXY	0.8880
883	HH8	0.8880
884	ADA	0.8880
885	JBN	0.8880
886	PBN	0.8879
887	PEP	0.8878
888	S7J	0.8878
889	2F6	0.8877
890	OVP	0.8877
891	GCS	0.8877
892	141	0.8876
893	LRH	0.8875
894	4RU	0.8875
895	SHG	0.8875
896	2H5	0.8875
897	PH3	0.8874
898	O72	0.8873
899	PRZ	0.8873
900	ADE	0.8873
901	SNE	0.8872
902	HX2	0.8871
903	BOA	0.8870
904	15E	0.8869
905	ISD	0.8868
906	MPV	0.8866
907	KJY	0.8864
908	IGA	0.8863
909	6NA	0.8863
910	B53	0.8859
911	290	0.8858
912	EXD	0.8858
913	10L	0.8857
914	4PN	0.8854
915	ES4	0.8853
916	6TZ	0.8852
917	8W9	0.8851
918	HGQ	0.8851
919	9DA	0.8850
920	ALL	0.8847
921	1NP	0.8846
922	JTH	0.8845
923	DAV	0.8844
924	TTY	0.8843
925	XCZ	0.8843
926	AS3	0.8839
927	LYS	0.8839
928	FBV	0.8838
929	SYG	0.8837
930	DNF	0.8834
931	GLY GLY	0.8834
932	3Z7	0.8834
933	NVI	0.8834
934	PG3	0.8833
935	8U3	0.8832
936	273	0.8830
937	D1X	0.8830
938	DOR	0.8829
939	8XL	0.8828
940	OHJ	0.8825
941	3V4	0.8823
942	9TZ	0.8822
943	R67	0.8822
944	1A7	0.8821
945	T6C	0.8821
946	7WA	0.8820
947	KP6	0.8820
948	PM6	0.8819
949	1GN	0.8819
950	TFB	0.8819
951	265	0.8817
952	6CS	0.8817
953	23J	0.8817
954	285	0.8817
955	QBK	0.8816
956	6M1	0.8816
957	MAK	0.8815
958	FH2	0.8814
959	A7H	0.8814
960	BVC	0.8814
961	1HN	0.8813
962	UEG	0.8813
963	DTL	0.8813
964	ABE	0.8812
965	Q02	0.8812
966	B2J	0.8812
967	PRF	0.8811
968	FDK	0.8811
969	2A7	0.8811
970	URP	0.8810
971	Z13	0.8810
972	JAB	0.8808
973	ALE	0.8808
974	XDE	0.8808
975	LGC	0.8808
976	7MH	0.8808
977	60P	0.8807
978	HEW	0.8807
979	K5W	0.8807
980	MO8	0.8806
981	AJV	0.8806
982	61M	0.8806
983	VXX	0.8804
984	GTR	0.8804
985	FB1	0.8804
986	B62	0.8804
987	SME	0.8803
988	S76	0.8803
989	2CQ	0.8802
990	H76	0.8802
991	0W8	0.8802
992	URA	0.8802
993	0F9	0.8802
994	SOR	0.8801
995	PXM	0.8801
996	4JC	0.8801
997	MZT	0.8801
998	6MP	0.8798
999	7HP	0.8798
1000	DBX	0.8798
1001	ARB	0.8797
1002	S24	0.8796
1003	BMA	0.8795
1004	DAS	0.8795
1005	GVG	0.8794
1006	EVA	0.8794
1007	5AC	0.8792
1008	ZZ3	0.8792
1009	RCO	0.8791
1010	CRS	0.8790
1011	UFV	0.8789
1012	6F0	0.8788
1013	8IG	0.8788
1014	HQD	0.8787
1015	PQK	0.8787
1016	JBH	0.8786
1017	92P	0.8786
1018	HHQ	0.8786
1019	QX2	0.8785
1020	IMR	0.8785
1021	GBD	0.8785
1022	KIV	0.8785
1023	MLA	0.8784
1024	CIT	0.8783
1025	3IT	0.8783
1026	JG8	0.8782
1027	OTW	0.8781
1028	OMD	0.8781
1029	9HX	0.8780
1030	YHO	0.8780
1031	FA3	0.8780
1032	AW5	0.8779
1033	M3T	0.8778
1034	GLT	0.8777
1035	UAN	0.8777
1036	2FX	0.8777
1037	9MG	0.8776
1038	4NZ	0.8776
1039	YIO	0.8775
1040	GAG	0.8775
1041	ABU	0.8773
1042	APZ	0.8772
1043	QIC	0.8770
1044	GCB	0.8768
1045	8NX	0.8768
1046	CRN	0.8767
1047	B3R	0.8766
1048	SMV	0.8766
1049	BTE	0.8766
1050	8NB	0.8765
1051	FBF	0.8764
1052	HCI	0.8764
1053	AAN	0.8764
1054	1LM	0.8763
1055	KBG	0.8761
1056	BP1	0.8758
1057	2PG	0.8757
1058	C2Y	0.8757
1059	N3W	0.8756
1060	64K	0.8756
1061	TBP	0.8756
1062	R1X	0.8755
1063	IZC	0.8755
1064	PDC	0.8755
1065	34D	0.8755
1066	IJZ	0.8755
1067	OXQ	0.8754
1068	AOT	0.8754
1069	M4E	0.8753
1070	1DH	0.8752
1071	0FK	0.8751
1072	4H2	0.8751
1073	GRE	0.8750
1074	FUF	0.8747
1075	DQU	0.8747
1076	MLI	0.8747
1077	GLO	0.8745
1078	OXC	0.8745
1079	4ME	0.8744
1080	3CH	0.8743
1081	APS	0.8741
1082	ICF	0.8741
1083	DQA	0.8741
1084	25T	0.8740
1085	LG3	0.8740
1086	DHC	0.8740
1087	PJW	0.8739
1088	BVF	0.8738
1089	3PY	0.8738
1090	2AK	0.8737
1091	PEQ	0.8737
1092	JIF	0.8736
1093	XX3	0.8736
1094	6ME	0.8731
1095	1WG	0.8731
1096	YTX	0.8731
1097	150	0.8729
1098	4TU	0.8728
1099	CH9	0.8728
1100	44V	0.8726
1101	XHP	0.8725
1102	PMF	0.8725
1103	AZ9	0.8724
1104	ONR	0.8724
1105	QBM	0.8724
1106	4MU	0.8723
1107	CCU	0.8723
1108	APG	0.8723
1109	948	0.8722
1110	M0W	0.8720
1111	15L	0.8719
1112	2CL	0.8719
1113	CYT	0.8716
1114	HVQ	0.8716
1115	DRL	0.8715
1116	T9G	0.8715
1117	PFB	0.8715
1118	F4Z	0.8714
1119	P7Y	0.8713
1120	NVU	0.8712
1121	0N7	0.8710
1122	7CZ	0.8710
1123	0TR	0.8707
1124	152	0.8707
1125	3FH	0.8706
1126	MBG	0.8706
1127	L22	0.8705
1128	3PG	0.8704
1129	P2D	0.8703
1130	G5V	0.8702
1131	FCA	0.8702
1132	WOT	0.8700
1133	44W	0.8699
1134	42C	0.8698
1135	3AE	0.8698
1136	PQ0	0.8698
1137	SXS	0.8695
1138	8GF	0.8695
1139	EMZ	0.8694
1140	SWD	0.8693
1141	4V2	0.8693
1142	45C	0.8690
1143	DGL	0.8689
1144	GOO	0.8688
1145	RD4	0.8688
1146	RUJ	0.8685
1147	DMG	0.8685
1148	FOT	0.8684
1149	8HC	0.8681
1150	EYK	0.8681
1151	LG5	0.8678
1152	26D	0.8677
1153	2O6	0.8677
1154	FLC	0.8676
1155	MVN	0.8675
1156	1U6	0.8675
1157	CIG	0.8674
1158	LEA	0.8674
1159	0OC	0.8674
1160	HY3	0.8673
1161	2KT	0.8673
1162	BZJ	0.8673
1163	MUA	0.8672
1164	2DR	0.8672
1165	HDL	0.8672
1166	LKA	0.8672
1167	E60	0.8671
1168	GZ3	0.8670
1169	XXG	0.8670
1170	8K2	0.8670
1171	P9E	0.8669
1172	LR5	0.8668
1173	A13	0.8667
1174	1DQ	0.8664
1175	Z5P	0.8663
1176	TM4	0.8663
1177	280	0.8662
1178	GZQ	0.8660
1179	7VS	0.8659
1180	AN3	0.8659
1181	A09	0.8659
1182	8G0	0.8658
1183	0FO	0.8657
1184	R2P	0.8657
1185	MZ0	0.8657
1186	95Z	0.8655
1187	2FQ	0.8654
1188	ECE	0.8653
1189	CEJ	0.8651
1190	KBZ	0.8650
1191	4LW	0.8649
1192	1BN	0.8648
1193	QX4	0.8647
1194	PYG	0.8643
1195	260	0.8643
1196	Q6T	0.8642
1197	X0U	0.8639
1198	284	0.8639
1199	M6N	0.8637
1200	KBB	0.8634
1201	HPY	0.8634
1202	DIU	0.8633
1203	2ZV	0.8631
1204	TC7	0.8630
1205	ARP	0.8630
1206	PH2	0.8630
1207	HHR	0.8630
1208	GXE	0.8628
1209	TYR	0.8628
1210	BVG	0.8627
1211	4XF	0.8626
1212	G6D	0.8626
1213	1XX	0.8625
1214	HQ9	0.8625
1215	SSN	0.8625
1216	DVQ	0.8625
1217	C5J	0.8625
1218	7ME	0.8621
1219	NK2	0.8620
1220	T2C	0.8619
1221	ICC	0.8619
1222	3VX	0.8619
1223	CTS	0.8618
1224	VK3	0.8618
1225	HXX	0.8613
1226	TMZ	0.8611
1227	C2U	0.8607
1228	PIH	0.8605
1229	4XX	0.8602
1230	UFO	0.8600
1231	RUU	0.8599
1232	TWO	0.8598
1233	VAL	0.8597
1234	P84	0.8597
1235	ARA	0.8595
1236	P80	0.8593
1237	6MH	0.8592
1238	57O	0.8586
1239	N1E	0.8585
1240	GCO	0.8583
1241	86L	0.8582
1242	1XN	0.8580
1243	AAE	0.8578
1244	DUC	0.8577
1245	FLA	0.8577
1246	7D2	0.8572
1247	EN1	0.8570
1248	M0Q	0.8567
1249	NAG	0.8566
1250	ZZZ	0.8565
1251	2EZ	0.8564
1252	ZYR	0.8562
1253	24T	0.8561
1254	P4B	0.8553
1255	PGA	0.8551
1256	6X8	0.8551
1257	FBU	0.8547
1258	1WC	0.8544
1259	S0E	0.8541
1260	7WR	0.8537
1261	CLZ	0.8530
1262	YTB	0.8529
1263	EUE	0.8526
1264	MBN	0.8525
1265	9PY	0.8523
1266	HIU	0.8523
1267	Y3L	0.8520
1268	9BF	0.8513

Ligand no: 2; Ligand: CYT; Similar ligands found: 787

No:	Ligand	Similarity coefficient
1	RCO	1.0000
2	DUC	1.0000
3	CIG	1.0000
4	8GF	1.0000
5	BVF	1.0000
6	LG5	1.0000
7	LG3	1.0000
8	URA	1.0000
9	26D	1.0000
10	CRS	1.0000
11	3CH	0.9997
12	284	0.9984
13	M3T	0.9950
14	HGQ	0.9930
15	4H2	0.9927
16	B3R	0.9927
17	HEW	0.9915
18	HPY	0.9878
19	IDH	0.9860
20	HHQ	0.9836
21	24T	0.9827
22	RSF	0.9827
23	HYN	0.9793
24	3ZQ	0.9793
25	CYH	0.9782
26	CXL	0.9781
27	V1L	0.9780
28	URF	0.9757
29	XYP	0.9754
30	E60	0.9737
31	WBU	0.9732
32	6UA	0.9723
33	CEJ	0.9723
34	HAI	0.9721
35	13X	0.9720
36	285	0.9718
37	1MC	0.9717
38	TDR	0.9711
39	WDL	0.9710
40	5ZE	0.9710
41	4ZE	0.9709
42	AX2	0.9708
43	MCT	0.9706
44	9PO	0.9704
45	3AY	0.9703
46	HVK	0.9703
47	MWM	0.9702
48	IPH	0.9698
49	40O	0.9697
50	3MC	0.9695
51	MBD	0.9695
52	ICP	0.9692
53	PYD	0.9692
54	275	0.9691
55	2AC	0.9690
56	3FA	0.9687
57	A2Q	0.9686
58	XBZ	0.9686
59	CAQ	0.9685
60	LGA	0.9683
61	A1U	0.9679
62	FFP	0.9677
63	GMN	0.9675
64	PYG	0.9675
65	3AP	0.9674
66	XYD	0.9673
67	92Z	0.9672
68	2AP	0.9672
69	4HO	0.9672
70	8LG	0.9671
71	2DR	0.9670
72	34A	0.9669
73	FLM	0.9669
74	2MP	0.9668
75	TM7	0.9667
76	2ZX	0.9666
77	2C9	0.9665
78	WOT	0.9662
79	HRZ	0.9660
80	2MY	0.9659
81	MBN	0.9659
82	BR8	0.9659
83	4AP	0.9658
84	5UC	0.9657
85	L89	0.9656
86	FP2	0.9653
87	1AN	0.9649
88	93Q	0.9648
89	76X	0.9645
90	25T	0.9644
91	5MH	0.9644
92	282	0.9642
93	6MH	0.9639
94	2AF	0.9637
95	7EX	0.9637
96	TM4	0.9636
97	4CL	0.9633
98	HT4	0.9627
99	43M	0.9627
100	OXE	0.9625
101	3CE	0.9624
102	4JJ	0.9624
103	5JC	0.9624
104	5AN	0.9623
105	MZG	0.9623
106	TH0	0.9623
107	ERH	0.9622
108	280	0.9619
109	2IM	0.9616
110	2YU	0.9612
111	XIX	0.9612
112	BR9	0.9610
113	JZ2	0.9607
114	H3M	0.9606
115	2CH	0.9603
116	DMG	0.9603
117	JZ0	0.9602
118	BEW	0.9599
119	4JO	0.9598
120	2CM	0.9597
121	8CL	0.9595
122	DUB	0.9590
123	GXE	0.9589
124	47J	0.9582
125	27Y	0.9579
126	HTS	0.9578
127	MWJ	0.9573
128	938	0.9569
129	3MH	0.9562
130	QOS	0.9556
131	DTI	0.9556
132	ECE	0.9555
133	IUR	0.9549
134	TMT	0.9546
135	NK	0.9546
136	HSL	0.9537
137	HHN	0.9526
138	6X8	0.9520
139	ICC	0.9519
140	RP7	0.9516
141	C5J	0.9516
142	LXC	0.9514
143	L60	0.9510
144	MLM	0.9503
145	TLD	0.9501
146	AHR	0.9499
147	2KT	0.9498
148	MB3	0.9497
149	JZ3	0.9496
150	TTO	0.9496
151	SYN	0.9493
152	ABN	0.9489
153	93B	0.9480
154	MLI	0.9480
155	PYF	0.9478
156	ADE	0.9477
157	HBX	0.9476
158	0R0	0.9475
159	MLA	0.9474
160	HPA	0.9474
161	KSW	0.9470
162	C2A	0.9468
163	4JP	0.9465
164	J1Z	0.9462
165	HGW	0.9458
166	BZI	0.9458
167	MZ0	0.9457
168	0R1	0.9457
169	GVH	0.9457
170	GAG	0.9455
171	MMZ	0.9455
172	0CT	0.9453
173	23A	0.9451
174	6MP	0.9451
175	Y8I	0.9447
176	YAN	0.9447
177	94N	0.9442
178	7HP	0.9441
179	IND	0.9440
180	GBD	0.9440
181	9HX	0.9440
182	DTL	0.9437
183	LZ1	0.9434
184	23W	0.9434
185	DEN	0.9433
186	OXQ	0.9430
187	MPI	0.9429
188	9DA	0.9428
189	TCZ	0.9426
190	HIU	0.9426
191	FPI	0.9425
192	PIH	0.9425
193	TMZ	0.9424
194	BZF	0.9424
195	1XX	0.9424
196	1PT	0.9423
197	M2H	0.9417
198	DMI	0.9417
199	DGY	0.9412
200	HY3	0.9411
201	XYS	0.9410
202	4XX	0.9409
203	MLT	0.9404
204	R8S	0.9401
205	AMC	0.9399
206	PY7	0.9397
207	APY	0.9396
208	PM6	0.9395
209	5AC	0.9394
210	0TR	0.9390
211	278	0.9385
212	BP1	0.9375
213	ES4	0.9375
214	10L	0.9374
215	P2D	0.9372
216	NBE	0.9372
217	BTE	0.9371
218	1DH	0.9371
219	PLQ	0.9367
220	DXX	0.9367
221	IDM	0.9367
222	YHO	0.9366
223	7WA	0.9365
224	4AX	0.9360
225	O7U	0.9349
226	JIF	0.9346
227	3Z7	0.9345
228	GOL	0.9344
229	F05	0.9340
230	4ZC	0.9339
231	FPY	0.9335
232	KG7	0.9334
233	MAK	0.9332
234	286	0.9330
235	2A7	0.9330
236	1MR	0.9327
237	4JU	0.9327
238	7CZ	0.9325
239	HQE	0.9324
240	9EW	0.9321
241	HLR	0.9315
242	DSN	0.9314
243	1DW	0.9311
244	6AI	0.9307
245	DA1	0.9306
246	60P	0.9306
247	BZX	0.9304
248	CYS	0.9301
249	FPN	0.9299
250	PCR	0.9295
251	LG4	0.9294
252	4XR	0.9291
253	PYJ	0.9290
254	PXY	0.9289
255	SWD	0.9285
256	NMJ	0.9281
257	P3K	0.9278
258	DFB	0.9277
259	SER	0.9276
260	NVI	0.9274
261	25R	0.9273
262	SVN	0.9268
263	3PY	0.9268
264	JZ1	0.9264
265	150	0.9262
266	MZW	0.9259
267	2K4	0.9259
268	5MB	0.9259
269	IFM	0.9255
270	5H1	0.9254
271	2MH	0.9252
272	6HQ	0.9247
273	1WG	0.9245
274	5MI	0.9241
275	T6C	0.9241
276	14O	0.9240
277	NEQ	0.9239
278	S76	0.9237
279	ES9	0.9236
280	B24	0.9235
281	BAQ	0.9232
282	3MT	0.9226
283	0RW	0.9223
284	3U4	0.9221
285	FOA	0.9218
286	AMT	0.9217
287	4SV	0.9214
288	0MK	0.9214
289	RIP	0.9213
290	RIB	0.9211
291	F60	0.9211
292	SAL	0.9209
293	ARB	0.9208
294	4HS	0.9207
295	R8A	0.9207
296	BVC	0.9205
297	35C	0.9204
298	1CB	0.9202
299	3XX	0.9200
300	7MH	0.9199
301	3TR	0.9198
302	F81	0.9196
303	9CL	0.9196
304	BE2	0.9195
305	4JN	0.9193
306	BML	0.9190
307	ES6	0.9190
308	11S	0.9186
309	4CH	0.9186
310	2CQ	0.9186
311	4DX	0.9180
312	AZF	0.9178
313	265	0.9177
314	H4N	0.9177
315	VAL	0.9174
316	OXZ	0.9173
317	MR3	0.9171
318	JZ9	0.9171
319	FYU	0.9165
320	PYC	0.9163
321	HOW	0.9162
322	ARA	0.9158
323	PRO	0.9155
324	YTB	0.9155
325	8GC	0.9154
326	F4Z	0.9152
327	5MP	0.9150
328	TZC	0.9147
329	JFD	0.9146
330	GBL	0.9141
331	DFU	0.9141
332	KIV	0.9141
333	L3Q	0.9138
334	AUD	0.9138
335	FUC	0.9138
336	45C	0.9136
337	JBN	0.9135
338	FK1	0.9133
339	BEN	0.9133
340	AGK	0.9132
341	1MZ	0.9130
342	H76	0.9130
343	NCA	0.9129
344	SEJ	0.9127
345	2AI	0.9126
346	2MZ	0.9123
347	5RG	0.9123
348	AZA	0.9121
349	4MZ	0.9120
350	QUZ	0.9119
351	A2F	0.9117
352	ABA	0.9116
353	TP5	0.9115
354	B20	0.9115
355	64K	0.9115
356	TAR	0.9115
357	ATQ	0.9114
358	6AP	0.9113
359	3HB	0.9112
360	OHG	0.9111
361	25W	0.9111
362	AAE	0.9110
363	1WD	0.9110
364	8NY	0.9110
365	4CS	0.9109
366	FW5	0.9107
367	1DU	0.9104
368	BEZ	0.9103
369	JAB	0.9102
370	IGA	0.9102
371	ASP	0.9101
372	PZA	0.9100
373	Z6J	0.9099
374	BVG	0.9098
375	TC7	0.9097
376	9TY	0.9095
377	HMH	0.9095
378	MZY	0.9092
379	3NT	0.9091
380	6M9	0.9091
381	HVQ	0.9090
382	GUN	0.9089
383	JAE	0.9087
384	ZZ3	0.9087
385	AZG	0.9086
386	9DG	0.9086
387	53C	0.9084
388	GIF	0.9084
389	NBZ	0.9083
390	TBP	0.9082
391	C21	0.9081
392	IOL	0.9080
393	9X7	0.9080
394	VGL	0.9080
395	XAN	0.9080
396	290	0.9079
397	JZ6	0.9079
398	YH7	0.9076
399	YCP	0.9075
400	5HN	0.9074
401	0PY	0.9073
402	5KX	0.9072
403	BNZ	0.9072
404	6M4	0.9071
405	3AB	0.9071
406	P1R	0.9071
407	JKE	0.9067
408	FUF	0.9066
409	6PC	0.9062
410	OXL	0.9062
411	LER	0.9061
412	SMV	0.9061
413	FUL	0.9060
414	OXM	0.9060
415	BYZ	0.9059
416	141	0.9058
417	G6D	0.9056
418	NIO	0.9054
419	XQG	0.9053
420	CFP	0.9051
421	NPY	0.9051
422	GAB	0.9049
423	6GU	0.9049
424	12M	0.9049
425	3GR	0.9047
426	273	0.9046
427	BOA	0.9046
428	DX4	0.9046
429	3SK	0.9044
430	ES3	0.9044
431	1AC	0.9043
432	2PC	0.9043
433	THR	0.9041
434	PHZ	0.9040
435	OVV	0.9040
436	R2B	0.9037
437	AX7	0.9037
438	IP0	0.9037
439	270	0.9037
440	M1E	0.9036
441	OXD	0.9030
442	GTQ	0.9029
443	ADK	0.9028
444	WCE	0.9028
445	3BZ	0.9027
446	HGY	0.9024
447	54G	0.9023
448	KOJ	0.9023
449	03W	0.9021
450	F5B	0.9020
451	VNJ	0.9018
452	7WV	0.9018
453	LDU	0.9017
454	GLC	0.9016
455	Q88	0.9015
456	P92	0.9014
457	ABE	0.9013
458	HH5	0.9012
459	2RA	0.9012
460	HX3	0.9012
461	1AB	0.9009
462	DBB	0.9009
463	A3B	0.9009
464	5M0	0.9008
465	BAM	0.9008
466	EDG	0.9007
467	1XM	0.9006
468	DAL	0.9000
469	ZZT	0.9000
470	ITN	0.8996
471	BRT	0.8994
472	DAB	0.8994
473	1P3	0.8993
474	ALO	0.8991
475	FCA	0.8991
476	0CU	0.8989
477	CIZ	0.8989
478	2OP	0.8989
479	3MA	0.8988
480	UNU	0.8987
481	HUI	0.8986
482	14J	0.8982
483	2MI	0.8981
484	7HQ	0.8981
485	PYZ	0.8979
486	I3A	0.8979
487	KYD	0.8975
488	51F	0.8975
489	SMB	0.8974
490	URQ	0.8973
491	PCA	0.8970
492	PYR	0.8970
493	2XX	0.8969
494	ALA	0.8965
495	LMR	0.8963
496	DCY	0.8963
497	NTN	0.8962
498	CRN	0.8961
499	M1A	0.8960
500	HBA	0.8960
501	24B	0.8959
502	OAA	0.8959
503	5MK	0.8958
504	ES0	0.8954
505	6CS	0.8953
506	6SP	0.8952
507	BP9	0.8952
508	TH7	0.8945
509	ABV	0.8944
510	261	0.8943
511	192	0.8942
512	ADZ	0.8941
513	R1X	0.8941
514	IMR	0.8941
515	CP	0.8941
516	LAC	0.8935
517	PRS	0.8935
518	M58	0.8934
519	F0J	0.8933
520	GXV	0.8932
521	BCP	0.8930
522	HMU	0.8930
523	SX1	0.8929
524	PYM	0.8927
525	1XN	0.8926
526	9TZ	0.8925
527	GIO	0.8922
528	TFB	0.8922
529	SS2	0.8922
530	AC0	0.8922
531	CWM	0.8921
532	URP	0.8921
533	4SD	0.8915
534	HSE	0.8914
535	NAK	0.8911
536	3ZS	0.8902
537	FLA	0.8902
538	42A	0.8899
539	IT2	0.8897
540	DPR	0.8896
541	FCB	0.8894
542	DIE	0.8892
543	V55	0.8891
544	JZ5	0.8890
545	3OC	0.8889
546	NOJ	0.8887
547	NCM	0.8887
548	TLA	0.8887
549	7B4	0.8886
550	4VP	0.8885
551	67N	0.8885
552	PHB	0.8884
553	PRI	0.8884
554	4JL	0.8883
555	N5J	0.8882
556	TMH	0.8882
557	5Q0	0.8881
558	KPL	0.8881
559	QSC	0.8881
560	2EZ	0.8880
561	1LQ	0.8879
562	1P7	0.8878
563	HIO	0.8877
564	RM1	0.8876
565	MAE	0.8875
566	39J	0.8875
567	JBK	0.8875
568	ES1	0.8874
569	RUU	0.8874
570	3F0	0.8873
571	PBE	0.8872
572	JPZ	0.8869
573	GYE	0.8868
574	PBC	0.8868
575	7WG	0.8868
576	4YS	0.8867
577	5IQ	0.8865
578	PAF	0.8864
579	MRY	0.8862
580	BUO	0.8861
581	1LM	0.8859
582	5B1	0.8859
583	2CK	0.8859
584	1SQ	0.8857
585	JBH	0.8856
586	5SG	0.8854
587	NSP	0.8854
588	O72	0.8853
589	FP1	0.8853
590	1NP	0.8852
591	PAE	0.8850
592	HZP	0.8848
593	FAN	0.8847
594	DBH	0.8845
595	G2F	0.8845
596	HQY	0.8844
597	GOO	0.8844
598	NIS	0.8843
599	UY7	0.8843
600	UGC	0.8843
601	MFB	0.8834
602	LZM	0.8833
603	4HM	0.8832
604	9YL	0.8831
605	3M0	0.8831
606	XXR	0.8829
607	3HA	0.8828
608	2ZV	0.8828
609	6LW	0.8825
610	RSO	0.8822
611	5Y9	0.8822
612	C2N	0.8821
613	5OB	0.8821
614	AKB	0.8818
615	IHG	0.8818
616	HCS	0.8818
617	RNS	0.8814
618	SS1	0.8811
619	RM4	0.8811
620	FPK	0.8810
621	32O	0.8807
622	NVA	0.8807
623	UYA	0.8801
624	3DM	0.8797
625	TZE	0.8796
626	OXC	0.8794
627	BAE	0.8794
628	G4D	0.8794
629	JFJ	0.8794
630	HH8	0.8793
631	RAM	0.8789
632	QWN	0.8788
633	3MB	0.8786
634	JB5	0.8786
635	4M4	0.8783
636	IPZ	0.8783
637	FBA	0.8780
638	SSN	0.8778
639	OVM	0.8777
640	MRZ	0.8777
641	9X6	0.8776
642	ASN	0.8776
643	6F0	0.8776
644	EXO	0.8775
645	JBE	0.8773
646	GRE	0.8773
647	BSX	0.8772
648	NXA	0.8771
649	FQI	0.8770
650	24W	0.8770
651	7W4	0.8769
652	8H8	0.8768
653	40E	0.8765
654	SGL	0.8765
655	69O	0.8764
656	IQ0	0.8761
657	4XH	0.8759
658	BZ3	0.8759
659	3OH	0.8758
660	H8N	0.8758
661	EUG	0.8757
662	DOR	0.8757
663	MMU	0.8756
664	HYP	0.8754
665	03V	0.8752
666	82I	0.8752
667	COU	0.8750
668	EQT	0.8749
669	2LP	0.8748
670	5NU	0.8743
671	5CU	0.8740
672	QXW	0.8739
673	2AQ	0.8737
674	ORO	0.8735
675	IFL	0.8735
676	4FS	0.8734
677	PEA	0.8734
678	ISN	0.8733
679	BNS	0.8730
680	C2B	0.8728
681	ES5	0.8727
682	FUB	0.8726
683	FRU	0.8725
684	JZ4	0.8722
685	98J	0.8721
686	LRH	0.8720
687	XM0	0.8719
688	DMD	0.8717
689	HHA	0.8717
690	717	0.8716
691	KKN	0.8712
692	DTU	0.8711
693	3DO	0.8710
694	T2C	0.8709
695	ALQ	0.8709
696	260	0.8708
697	1SP	0.8705
698	MEU	0.8704
699	7NI	0.8703
700	BHA	0.8702
701	4JM	0.8700
702	5VM	0.8699
703	34D	0.8695
704	9MG	0.8695
705	XQ0	0.8694
706	5WV	0.8692
707	N8P	0.8691
708	4PW	0.8691
709	DOB	0.8691
710	4M0	0.8690
711	1DQ	0.8685
712	CEE	0.8684
713	VGD	0.8683
714	1LN	0.8680
715	ASO	0.8680
716	3ID	0.8680
717	42C	0.8679
718	FA0	0.8678
719	II6	0.8678
720	XBT	0.8675
721	BAL	0.8674
722	DYA	0.8674
723	IOM	0.8674
724	TIU	0.8673
725	DGJ	0.8672
726	MAN	0.8670
727	TB6	0.8670
728	GAL	0.8669
729	B53	0.8668
730	AW5	0.8662
731	H42	0.8662
732	Q6T	0.8659
733	G5V	0.8656
734	EGD	0.8651
735	SIN	0.8651
736	2D0	0.8650
737	I2M	0.8648
738	FBV	0.8646
739	4NC	0.8645
740	MR1	0.8644
741	PEL	0.8639
742	DMJ	0.8638
743	D1X	0.8636
744	ET2	0.8636
745	XUL	0.8631
746	FDB	0.8631
747	XRG	0.8630
748	HSM	0.8630
749	TEO	0.8630
750	6M1	0.8628
751	UNC	0.8621
752	DCD	0.8615
753	ZBT	0.8615
754	DHB	0.8615
755	LCN	0.8613
756	FOT	0.8612
757	51R	0.8611
758	DAS	0.8608
759	IF7	0.8608
760	MYJ	0.8607
761	93K	0.8607
762	NPO	0.8607
763	CSS	0.8607
764	8IG	0.8605
765	S0H	0.8600
766	PZI	0.8599
767	ILE	0.8593
768	C2U	0.8590
769	PRY	0.8590
770	N7P	0.8589
771	NNO	0.8589
772	271	0.8585
773	BTY	0.8584
774	8EZ	0.8582
775	NOY	0.8582
776	BHO	0.8578
777	B55	0.8577
778	IJZ	0.8572
779	P9P	0.8568
780	6JN	0.8561
781	SAR	0.8560
782	HY1	0.8556
783	BUA	0.8549
784	EV0	0.8543
785	Z82	0.8533
786	RB5	0.8524
787	5JL	0.8521

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

Pocket No.: 1; Query (leader) PDB : 3JVH; Ligand: HHV; 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: 3jvh.bio1) has 33 residues
No:	Leader PDB	Ligand	Sequence Similarity

Pocket No.: 2; Query (leader) PDB : 3JVH; Ligand: HHV; 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: 3jvh.bio1) has 24 residues
No:	Leader PDB	Ligand	Sequence Similarity

Pocket No.: 3; Query (leader) PDB : 3JVH; Ligand: HHV; 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: 3jvh.bio1) has 24 residues
No:	Leader PDB	Ligand	Sequence Similarity

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