Binding MOAD - The Mother of All Databases

Navigate: Expand All | Collapse All; Receptor | Ligand | View in 3D; Family: 90% | 70% | 50% | site
External Links: |
Download: Structure Biounit | Ligand Information; PDB : .ZIP | .CSV; Family 90% : .ZIP | .CSV; Class : .ZIP | .CSV

Receptor

PDB id	Resolution	Class	Description	Source	Keywords
1AJ0	2 Å	EC: 2.5.1.15	CRYSTAL STRUCTURE OF A TERNARY COMPLEX OF E. COLI DIHYDROPTE SYNTHASE	ESCHERICHIA COLI	ANTIBIOTIC RESISTANCE TRANSFERASE FOLATE BIOSYNTHESIS S
Ref.:	CRYSTAL STRUCTURE OF THE ANTI-BACTERIAL SULFONAMIDE TARGET DIHYDROPTEROATE SYNTHASE. NAT.STRUCT.BIOL. V. 4 490 1997

Ligand

Ligand	Chain:Residue	Validity	Ligand Warnings	Binding Data	Molecular Weight (Da)	Formula	SMILES
PH2	A:559;	Valid;	none;	submit data	195.179	C7 H9 N5 O2	C1C(=...
SAN	A:561;	Valid;	none;	submit data	172.205	C6 H8 N2 O2 S	c1cc(...
SO4	A:284;	Invalid;	none;	submit data	96.063	O4 S	[O-]S...

View in 3D viewer

90% Homology Family

Leader

PDB id	Resolution	Class	Description	Source	Keywords
1AJ0	2 Å	EC: 2.5.1.15	CRYSTAL STRUCTURE OF A TERNARY COMPLEX OF E. COLI DIHYDROPTE SYNTHASE	ESCHERICHIA COLI	ANTIBIOTIC RESISTANCE TRANSFERASE FOLATE BIOSYNTHESIS S
Ref.:	CRYSTAL STRUCTURE OF THE ANTI-BACTERIAL SULFONAMIDE TARGET DIHYDROPTEROATE SYNTHASE. NAT.STRUCT.BIOL. V. 4 490 1997

Members (13)

No:	PDB id	Binding Data	Representative ligand	Formula	Smiles
The Class containing this family consists of a total of 8 families.
1	1AJ0	-	SAN	C6 H8 N2 O2 S	c1cc(ccc1N....
2	5U10	-	PT1	C14 H12 N6 O3	c1cc(ccc1C....
3	5U0W	-	9MG	C6 H7 N5 O	Cn1cnc2c1n....
4	5U0V	-	7VJ	C5 H7 N5 O2	CNC1=C(C(=....
5	5U14	-	7PV	C13 H14 N6 O3 S2	c1cc(ccc1C....
6	5U0Z	-	7PM	C13 H11 N5 O3 S	c1ccc(cc1)....
7	5V7A	-	8Y7	C8 H9 N5 O3 S	Cn1c2c(nc1....
8	5U0Y	-	7PJ	C7 H7 N5 O3 S	C(C(=O)O)S....
9	5V79	-	8Y4	C14 H14 N6 O2 S	Cn1c2c(nc1....
10	5U13	-	YH5	C14 H13 N5 O3 S	COc1ccc(cc....
11	5U11	-	7PS	C8 H10 N6 O2 S	CNC(=O)CSc....
12	5U12	-	5RU	C12 H10 F N5 O S	c1ccc(c(c1....
13	1AJ2	-	2PH	C7 H11 N5 O8 P2	C1C(=NC2=C....

70% Homology Family (16)

No:	PDB id	Binding Data	Representative ligand	Formula	Smiles
The Class containing this family consists of a total of 7 families.
1	1AJ0	-	SAN	C6 H8 N2 O2 S	c1cc(ccc1N....
2	5U10	-	PT1	C14 H12 N6 O3	c1cc(ccc1C....
3	5U0W	-	9MG	C6 H7 N5 O	Cn1cnc2c1n....
4	5U0V	-	7VJ	C5 H7 N5 O2	CNC1=C(C(=....
5	5U14	-	7PV	C13 H14 N6 O3 S2	c1cc(ccc1C....
6	5U0Z	-	7PM	C13 H11 N5 O3 S	c1ccc(cc1)....
7	5V7A	-	8Y7	C8 H9 N5 O3 S	Cn1c2c(nc1....
8	5U0Y	-	7PJ	C7 H7 N5 O3 S	C(C(=O)O)S....
9	5V79	-	8Y4	C14 H14 N6 O2 S	Cn1c2c(nc1....
10	5U13	-	YH5	C14 H13 N5 O3 S	COc1ccc(cc....
11	5U11	-	7PS	C8 H10 N6 O2 S	CNC(=O)CSc....
12	5U12	-	5RU	C12 H10 F N5 O S	c1ccc(c(c1....
13	1AJ2	-	2PH	C7 H11 N5 O8 P2	C1C(=NC2=C....
14	3TYZ	-	PAB	C7 H7 N O2	c1cc(ccc1C....
15	3TZF	-	HH2	C7 H9 N5 O8 P2	c1c(nc2c(n....
16	5JQ9	-	6MB	C18 H18 N8 O4 S	Cc1c(noc1N....

50% Homology Family (46)

No:	PDB id	Binding Data	Representative ligand	Formula	Smiles
The Class containing this family consists of a total of 2 families.
1	1AJ0	-	SAN	C6 H8 N2 O2 S	c1cc(ccc1N....
2	5U10	-	PT1	C14 H12 N6 O3	c1cc(ccc1C....
3	5U0W	-	9MG	C6 H7 N5 O	Cn1cnc2c1n....
4	5U0V	-	7VJ	C5 H7 N5 O2	CNC1=C(C(=....
5	5U14	-	7PV	C13 H14 N6 O3 S2	c1cc(ccc1C....
6	5U0Z	-	7PM	C13 H11 N5 O3 S	c1ccc(cc1)....
7	5V7A	-	8Y7	C8 H9 N5 O3 S	Cn1c2c(nc1....
8	5U0Y	-	7PJ	C7 H7 N5 O3 S	C(C(=O)O)S....
9	5V79	-	8Y4	C14 H14 N6 O2 S	Cn1c2c(nc1....
10	5U13	-	YH5	C14 H13 N5 O3 S	COc1ccc(cc....
11	5U11	-	7PS	C8 H10 N6 O2 S	CNC(=O)CSc....
12	5U12	-	5RU	C12 H10 F N5 O S	c1ccc(c(c1....
13	1AJ2	-	2PH	C7 H11 N5 O8 P2	C1C(=NC2=C....
14	4D8Z	Kd = 0.51 uM	0J2	C10 H11 N5 O4	C[C@H](CC(....
15	4DB7	Kd = 0.273 uM	Z25	C9 H9 N5 O4	C(CC(=O)O)....
16	4D8A	-	0HY	C11 H13 N5 O4	C[C@H](CC(....
17	4DAF	Kd = 0.076 uM	0J4	C9 H9 N5 O4	C[C@H](C1=....
18	3H22	ic50 = 8 uM	B53	C4 H5 N5 O2	C1(=C(N=C(....
19	4NIL	-	2O8	C8 H6 F3 N O S	c1cc(ccc1C....
20	1TX2	-	680	C5 H7 N5 O3	CNC1=C(C(=....
21	1TWW	-	HH2	C7 H9 N5 O8 P2	c1c(nc2c(n....
22	3TYE	-	XHP	C7 H7 N5 O	C=C1CN=C2C....
23	3H2M	ic50 = 215 uM	B61	C11 H17 N5 O2	CC(C)(CC1=....
24	3H24	-	B55	C5 H5 N5 O S	c12c([nH]c....
25	3TYC	-	XHP	C7 H7 N5 O	C=C1CN=C2C....
26	3H2F	ic50 = 86.7 uM	B60	C7 H9 N5 O	CN1CC=NC2=....
27	1TX0	-	PT1	C14 H12 N6 O3	c1cc(ccc1C....
28	3H21	ic50 = 19.8 uM	B52	C10 H11 N5 O4	C[C@H](C1=....
29	4D9P	ic50 = 145 uM	Z17	C11 H13 N5 O4	C[C@H](CC(....
30	3H26	ic50 = 32.4 uM	B56	C8 H9 N5 O3	CN1CC(=NC2....
31	3TYD	-	XHP	C7 H7 N5 O	C=C1CN=C2C....
32	4DAI	Kd = 110 nM	0J5	C8 H7 N5 O4	C(C1=NNC2=....
33	4NHV	-	2O6	C8 H5 F3 N2 O	c1cc2c(cc1....
34	3H2N	ic50 = 212.6 uM	B62	C7 H11 N5 O	C[C@@H]1CN....
35	4NL1	-	Z13	C16 H11 F6 N	c1cc(ccc1C....
36	3H23	ic50 = 19.3 uM	B54	C14 H15 N5 O5	c1cc(ccc1C....
37	3H2A	ic50 = 108.9 uM	B57	C4 H5 N5 O3	C1(=C(N=C(....
38	4NIR	-	6DH	C11 H11 F3 N2 O	c1cc2c(cc1....
39	1EYE	-	PMM	C7 H8 N5 O5 P	c1c(nc2c(n....
40	1AD4	-	HH2	C7 H9 N5 O8 P2	c1c(nc2c(n....
41	6CLV	-	6MB	C18 H18 N8 O4 S	Cc1c(noc1N....
42	2VEG	-	PMM	C7 H8 N5 O5 P	c1c(nc2c(n....
43	3TYZ	-	PAB	C7 H7 N O2	c1cc(ccc1C....
44	3TZF	-	HH2	C7 H9 N5 O8 P2	c1c(nc2c(n....
45	5JQ9	-	6MB	C18 H18 N8 O4 S	Cc1c(noc1N....
46	2Y5S	-	78H	C14 H14 N6 O3	c1cc(ccc1C....

Polypharmacology

Similar Ligands (2D)

Ligand no: 1; Ligand: PH2; Similar ligands found: 6

No:	Ligand	ECFP6 Tc	MDL keys Tc
1	PH2	1	1
2	2PH	0.55	0.830769
3	44W	0.5	0.857143
4	ZSP	0.482143	0.852459
5	78H	0.477612	0.898305
6	HBI	0.464286	0.852459

Ligand no: 2; Ligand: SAN; Similar ligands found: 14

No:	Ligand	ECFP6 Tc	MDL keys Tc
1	SAN	1	1
2	BC5	0.642857	0.930233
3	4WA	0.5625	0.909091
4	M4S	0.482759	0.729167
5	FBS	0.464286	0.795455
6	4J8	0.464286	0.853659
7	520	0.461538	0.869565
8	FB2	0.423077	0.875
9	4JC	0.419355	0.813953
10	KBZ	0.419355	0.857143
11	4NZ	0.419355	0.78
12	3W8	0.411765	0.686275
13	ZYX	0.40625	0.808511
14	0F3	0.40625	0.909091

Similar Ligands (3D)

Ligand no: 1; Ligand: PH2; Similar ligands found: 1274

No:	Ligand	Similarity coefficient
1	HHR	1.0000
2	ZZZ	1.0000
3	DQU	0.9929
4	XHP	0.9910
5	OTW	0.9906
6	B62	0.9905
7	MVN	0.9904
8	2K8	0.9897
9	QX4	0.9892
10	0FO	0.9859
11	PRF	0.9834
12	HHS	0.9808
13	9R5	0.9803
14	44V	0.9789
15	6ME	0.9788
16	FDR	0.9774
17	N8Y	0.9744
18	PQ0	0.9711
19	4JQ	0.9674
20	0TU	0.9666
21	MQN	0.9665
22	2FQ	0.9649
23	4YO	0.9640
24	B56	0.9630
25	CLZ	0.9606
26	8HC	0.9595
27	0FK	0.9588
28	KUF	0.9587
29	UFO	0.9571
30	QBK	0.9571
31	N0Z	0.9560
32	0P6	0.9559
33	8CM	0.9551
34	CWS	0.9544
35	AJV	0.9538
36	B5D	0.9517
37	8W9	0.9515
38	ZYR	0.9514
39	BEA	0.9512
40	2HQ	0.9509
41	3Z8	0.9507
42	3QV	0.9504
43	344	0.9501
44	XAZ	0.9486
45	MUA	0.9485
46	2AK	0.9476
47	8MO	0.9474
48	2KA	0.9473
49	BTY	0.9472
50	BCU	0.9470
51	8NX	0.9468
52	DNA	0.9467
53	TGX	0.9461
54	HBO	0.9457
55	20J	0.9456
56	BPU	0.9454
57	APZ	0.9453
58	N2I	0.9453
59	6Q3	0.9447
60	B55	0.9447
61	8TX	0.9446
62	4KL	0.9444
63	2EC	0.9443
64	86J	0.9438
65	H5B	0.9436
66	Q71	0.9434
67	URC	0.9428
68	75K	0.9427
69	JF2	0.9416
70	8ZE	0.9416
71	GJP	0.9414
72	2LY	0.9412
73	8IG	0.9409
74	BNX	0.9408
75	4RU	0.9408
76	4TU	0.9407
77	KDV	0.9397
78	94W	0.9396
79	1HN	0.9396
80	68A	0.9394
81	5RO	0.9392
82	5TY	0.9391
83	INE	0.9391
84	JU2	0.9389
85	0JD	0.9386
86	LOG	0.9384
87	5JL	0.9384
88	Q77	0.9380
89	12T	0.9380
90	NAG	0.9379
91	FBB	0.9379
92	K2T	0.9376
93	WSD	0.9374
94	C9E	0.9372
95	KT7	0.9371
96	5JQ	0.9365
97	DRG	0.9364
98	GDL	0.9357
99	M1Q	0.9357
100	8WT	0.9353
101	R9Y	0.9351
102	AA	0.9349
103	92P	0.9349
104	428	0.9347
105	7AP	0.9346
106	BZJ	0.9344
107	15N	0.9337
108	C2Y	0.9334
109	9ZE	0.9334
110	V1T	0.9333
111	VXX	0.9333
112	MO8	0.9328
113	JND	0.9327
114	MRW	0.9323
115	ANF	0.9323
116	DIN	0.9323
117	JXZ	0.9322
118	H4B	0.9321
119	4HC	0.9320
120	J6W	0.9320
121	CWJ	0.9319
122	HKD	0.9319
123	6KT	0.9319
124	BIO	0.9318
125	DX3	0.9318
126	7B3	0.9316
127	ARP	0.9315
128	PYQ	0.9313
129	BGU	0.9310
130	B21	0.9309
131	S60	0.9309
132	E1T	0.9303
133	JF1	0.9302
134	ROI	0.9302
135	4ME	0.9302
136	JXW	0.9298
137	H2B	0.9298
138	3ZB	0.9298
139	K3Q	0.9297
140	AQO	0.9296
141	15E	0.9296
142	4AB	0.9294
143	1QP	0.9294
144	97T	0.9293
145	EOL	0.9290
146	A7W	0.9288
147	209	0.9283
148	GXY	0.9282
149	6E8	0.9282
150	MEW	0.9278
151	E7S	0.9275
152	UNJ	0.9274
153	M6N	0.9273
154	H33	0.9273
155	Q24	0.9272
156	J9W	0.9272
157	JG8	0.9271
158	2FY	0.9271
159	GCS	0.9271
160	VOH	0.9270
161	APS	0.9268
162	PEY	0.9268
163	MAQ	0.9267
164	N91	0.9267
165	N7I	0.9267
166	NID	0.9265
167	0N7	0.9260
168	AJ2	0.9260
169	8WO	0.9260
170	CH9	0.9258
171	M5K	0.9257
172	28N	0.9255
173	IV2	0.9255
174	K97	0.9255
175	KTW	0.9254
176	PE0	0.9253
177	5NE	0.9253
178	36R	0.9253
179	NGA	0.9251
180	HNT	0.9250
181	AJY	0.9248
182	THA	0.9248
183	ESI	0.9247
184	ST2	0.9245
185	7MU	0.9245
186	6VD	0.9243
187	MS9	0.9243
188	1SS	0.9241
189	X0U	0.9241
190	SLS	0.9241
191	KYA	0.9240
192	FDB	0.9240
193	27B	0.9240
194	0XT	0.9240
195	A7H	0.9239
196	5VM	0.9239
197	92K	0.9237
198	4BY	0.9236
199	537	0.9235
200	0FN	0.9235
201	MQG	0.9231
202	1A7	0.9231
203	CK2	0.9231
204	AZ8	0.9231
205	A29	0.9229
206	HA5	0.9228
207	AP4	0.9227
208	E35	0.9227
209	HQD	0.9226
210	LDR	0.9225
211	MAG	0.9223
212	4FS	0.9221
213	5WU	0.9220
214	B60	0.9220
215	TOF	0.9218
216	TT4	0.9218
217	AN3	0.9217
218	BGC	0.9217
219	2A9	0.9216
220	1KP	0.9212
221	DPZ	0.9210
222	ET2	0.9205
223	03V	0.9204
224	J9T	0.9204
225	2D0	0.9202
226	4M0	0.9202
227	G3F	0.9202
228	CLW	0.9199
229	9FL	0.9198
230	2AQ	0.9195
231	3J8	0.9195
232	ES5	0.9194
233	RZH	0.9192
234	DEE	0.9192
235	2BG	0.9191
236	BHS	0.9191
237	4BL	0.9191
238	8S0	0.9191
239	3VX	0.9190
240	E1K	0.9190
241	XQ0	0.9187
242	BZ3	0.9187
243	A2G	0.9186
244	BHA	0.9186
245	TTY	0.9185
246	RXA	0.9184
247	TWO	0.9184
248	46P	0.9182
249	H42	0.9180
250	LNR	0.9180
251	GHM	0.9178
252	6FB	0.9178
253	GNM	0.9177
254	DOB	0.9177
255	NDG	0.9177
256	GSY	0.9175
257	FA0	0.9175
258	5NS	0.9175
259	549	0.9174
260	GC3	0.9172
261	JTH	0.9171
262	5OB	0.9171
263	CK1	0.9168
264	ES2	0.9167
265	VK3	0.9166
266	1M2	0.9165
267	4MU	0.9165
268	OCH	0.9164
269	AZ9	0.9164
270	NQ	0.9164
271	QIV	0.9164
272	61M	0.9164
273	DRL	0.9163
274	OQC	0.9163
275	EN1	0.9163
276	JXN	0.9162
277	BK9	0.9162
278	9CA	0.9160
279	M4E	0.9160
280	0J5	0.9160
281	6RQ	0.9160
282	1P8	0.9159
283	5XC	0.9158
284	COU	0.9157
285	SJK	0.9157
286	TIY	0.9156
287	BBK	0.9156
288	EE8	0.9155
289	TSS	0.9153
290	6QF	0.9152
291	I3A	0.9152
292	1IT	0.9150
293	3MG	0.9149
294	MD6	0.9149
295	4VS	0.9149
296	0HO	0.9148
297	9AP	0.9148
298	8XL	0.9147
299	1F1	0.9147
300	BPY	0.9146
301	JYT	0.9143
302	0FR	0.9142
303	JBZ	0.9142
304	KTJ	0.9142
305	EGR	0.9141
306	GO2	0.9141
307	1P7	0.9139
308	UAN	0.9139
309	J9Q	0.9138
310	BDP	0.9136
311	30G	0.9135
312	ICO	0.9133
313	5NI	0.9132
314	4I8	0.9132
315	GO8	0.9131
316	KIB	0.9129
317	5GV	0.9128
318	6NT	0.9128
319	3NY	0.9128
320	ODO	0.9127
321	JYB	0.9127
322	6NI	0.9127
323	7W1	0.9127
324	GLC	0.9126
325	4V2	0.9125
326	AC2	0.9124
327	2HU	0.9124
328	0HN	0.9124
329	D07	0.9122
330	L99	0.9122
331	F5C	0.9122
332	DHQ	0.9119
333	WS7	0.9119
334	2ZM	0.9119
335	7MX	0.9118
336	SOR	0.9116
337	LT2	0.9116
338	E7Z	0.9115
339	KJH	0.9115
340	DNF	0.9114
341	ZHA	0.9113
342	G3E	0.9113
343	9KT	0.9113
344	069	0.9113
345	5QY	0.9110
346	7ME	0.9110
347	37T	0.9110
348	NFM	0.9109
349	JAW	0.9107
350	B57	0.9107
351	3A9	0.9106
352	LZ2	0.9105
353	2CZ	0.9105
354	TTL	0.9103
355	5QX	0.9102
356	JB5	0.9102
357	7FF	0.9102
358	4Z4	0.9100
359	3PF	0.9100
360	12Q	0.9097
361	BA5	0.9096
362	EXD	0.9095
363	NDM	0.9094
364	TYL	0.9094
365	ABI	0.9094
366	LI6	0.9094
367	CFF	0.9094
368	L22	0.9089
369	XIY	0.9089
370	ANC	0.9088
371	KW8	0.9086
372	5NU	0.9086
373	54X	0.9084
374	AX3	0.9083
375	363	0.9081
376	39O	0.9080
377	ESP	0.9080
378	F2W	0.9079
379	H7Y	0.9078
380	J5I	0.9077
381	7VS	0.9077
382	CWM	0.9076
383	PJW	0.9074
384	5CU	0.9074
385	ALE	0.9073
386	XDE	0.9073
387	3Y7	0.9073
388	6X9	0.9072
389	SG2	0.9071
390	LDP	0.9071
391	32X	0.9070
392	O2A	0.9070
393	HQT	0.9067
394	MR1	0.9067
395	3R4	0.9065
396	9LI	0.9064
397	JDN	0.9064
398	M0W	0.9063
399	E7R	0.9063
400	3DO	0.9061
401	G12	0.9061
402	KMY	0.9061
403	GM7	0.9060
404	X0W	0.9060
405	4JT	0.9059
406	FF2	0.9059
407	RM1	0.9059
408	IAC	0.9056
409	KF5	0.9055
410	EA1	0.9054
411	D48	0.9053
412	SE2	0.9050
413	B61	0.9047
414	8NB	0.9046
415	SQ7	0.9046
416	Y3L	0.9045
417	1Z6	0.9045
418	KJY	0.9043
419	5B1	0.9043
420	7B4	0.9042
421	9FE	0.9041
422	ZVO	0.9040
423	DBJ	0.9040
424	HJH	0.9040
425	TSR	0.9040
426	JXK	0.9039
427	4XV	0.9039
428	SKA	0.9039
429	F9Y	0.9038
430	GCU	0.9038
431	CTL	0.9038
432	5OO	0.9037
433	0J4	0.9037
434	MNS	0.9036
435	42A	0.9034
436	L46	0.9033
437	ZEC	0.9031
438	HLZ	0.9030
439	7HQ	0.9030
440	GAL	0.9030
441	55D	0.9029
442	NSG	0.9029
443	ESX	0.9029
444	ZYQ	0.9028
445	3DM	0.9028
446	BQ2	0.9027
447	RH1	0.9027
448	ZME	0.9027
449	PQK	0.9026
450	M78	0.9026
451	M2K	0.9026
452	M0Q	0.9025
453	V55	0.9025
454	ICB	0.9024
455	ISN	0.9021
456	ES0	0.9021
457	FLV	0.9021
458	I3E	0.9021
459	AEH	0.9020
460	KJU	0.9020
461	SQ4	0.9020
462	VNL	0.9020
463	M1H	0.9018
464	BZ2	0.9018
465	GVG	0.9018
466	SYA	0.9017
467	S98	0.9017
468	W81	0.9016
469	VGD	0.9015
470	S0E	0.9014
471	SXS	0.9013
472	6FZ	0.9013
473	JB8	0.9012
474	SNG	0.9012
475	5RN	0.9012
476	MIG	0.9011
477	LGC	0.9011
478	SKF	0.9010
479	NDH	0.9010
480	BHQ	0.9010
481	N3W	0.9010
482	Z5P	0.9010
483	4M4	0.9010
484	8Y7	0.9006
485	JP2	0.9006
486	SRO	0.9005
487	3R6	0.9005
488	AMR	0.9004
489	N1E	0.9004
490	LZM	0.9003
491	SYV	0.9002
492	OA3	0.9001
493	GZL	0.9001
494	2HC	0.8999
495	2WU	0.8998
496	680	0.8997
497	0W1	0.8997
498	86L	0.8995
499	EUG	0.8994
500	HDH	0.8994
501	EV0	0.8994
502	QAS	0.8993
503	SNO	0.8991
504	FOT	0.8991
505	GLT	0.8990
506	ES7	0.8990
507	Q88	0.8990
508	H4E	0.8989
509	D8Q	0.8988
510	226	0.8988
511	A5E	0.8988
512	IWT	0.8987
513	GJS	0.8987
514	5GU	0.8986
515	SNU	0.8985
516	N2M	0.8984
517	ADZ	0.8984
518	FYU	0.8983
519	HHA	0.8982
520	ASC	0.8982
521	7I2	0.8982
522	GZ8	0.8981
523	I6G	0.8981
524	5WV	0.8980
525	CIY	0.8980
526	EYV	0.8977
527	MSR	0.8975
528	GF4	0.8974
529	MFZ	0.8974
530	F4E	0.8974
531	QAT	0.8973
532	4BZ	0.8971
533	PXL	0.8970
534	K37	0.8970
535	7W4	0.8970
536	MPU	0.8969
537	SHG	0.8969
538	NVU	0.8969
539	CG	0.8968
540	3HA	0.8967
541	INO	0.8967
542	K82	0.8966
543	TZF	0.8966
544	2F6	0.8966
545	ALL	0.8965
546	EUE	0.8965
547	KKN	0.8964
548	4AA	0.8964
549	X8D	0.8963
550	F6P	0.8961
551	3M0	0.8961
552	F0J	0.8960
553	DDU	0.8959
554	XM5	0.8959
555	8H8	0.8958
556	24W	0.8957
557	2O6	0.8956
558	4V6	0.8955
559	CCV	0.8955
560	X04	0.8955
561	QPR	0.8955
562	3IT	0.8955
563	PNZ	0.8955
564	7PJ	0.8954
565	9UL	0.8954
566	HHT	0.8953
567	EVA	0.8953
568	EMZ	0.8952
569	2ZQ	0.8951
570	7ZE	0.8951
571	QBM	0.8950
572	NDD	0.8949
573	0LH	0.8948
574	CFA	0.8948
575	RNO	0.8947
576	K22	0.8947
577	9MG	0.8947
578	3GQ	0.8946
579	4NC	0.8946
580	1SQ	0.8946
581	1QV	0.8946
582	878	0.8945
583	5VL	0.8945
584	ANN	0.8944
585	NEU	0.8943
586	OTR	0.8943
587	DHB	0.8943
588	LKA	0.8941
589	MWP	0.8941
590	FE DB1	0.8940
591	I4D	0.8940
592	XX2	0.8939
593	5WX	0.8939
594	Q6T	0.8938
595	HQJ	0.8938
596	DPT	0.8937
597	2GQ	0.8937
598	42C	0.8936
599	DBH	0.8935
600	GCB	0.8935
601	FQX	0.8934
602	KBG	0.8934
603	K44	0.8934
604	ABV	0.8934
605	M5H	0.8934
606	D3G	0.8933
607	IOS	0.8931
608	AH9	0.8930
609	K68	0.8930
610	K7H	0.8929
611	SHA	0.8927
612	LZB	0.8926
613	4XS	0.8926
614	XAN	0.8926
615	NNO	0.8926
616	64C	0.8925
617	QUS	0.8924
618	HMH	0.8924
619	HRM	0.8923
620	WOO	0.8923
621	67N	0.8923
622	MP5	0.8922
623	X11	0.8921
624	GUN	0.8921
625	Q7A	0.8920
626	ST1	0.8920
627	3F0	0.8918
628	3MB	0.8918
629	R8V	0.8918
630	2GS	0.8917
631	ST3	0.8917
632	MT5	0.8915
633	9DG	0.8914
634	MOK	0.8913
635	5LA	0.8913
636	ASO	0.8912
637	UNC	0.8912
638	505	0.8911
639	5WY	0.8911
640	OVM	0.8911
641	ITE	0.8911
642	B53	0.8910
643	EAE	0.8910
644	MS0	0.8909
645	1NP	0.8909
646	3N1	0.8909
647	OW7	0.8908
648	IOP	0.8907
649	NIZ	0.8907
650	CTS	0.8906
651	9BF	0.8906
652	JR2	0.8906
653	PFB	0.8906
654	SX1	0.8905
655	K25	0.8905
656	GTQ	0.8904
657	2F8	0.8903
658	GDE	0.8903
659	E5X	0.8903
660	93K	0.8903
661	7NI	0.8901
662	42J	0.8901
663	3WA	0.8901
664	ONZ	0.8900
665	CXH	0.8899
666	36M	0.8899
667	0W8	0.8899
668	AZA	0.8898
669	1LQ	0.8898
670	GI3	0.8897
671	JTA	0.8897
672	IJZ	0.8896
673	WS6	0.8896
674	GNV	0.8896
675	JBK	0.8895
676	2HO	0.8894
677	GTC	0.8894
678	2AL	0.8894
679	SLC	0.8893
680	XFE	0.8893
681	5SG	0.8892
682	5IQ	0.8892
683	ENO	0.8892
684	MAJ	0.8891
685	L5V	0.8891
686	2H5	0.8890
687	FHB	0.8890
688	CX6	0.8887
689	IL5	0.8886
690	SKM	0.8885
691	4A3	0.8885
692	IGA	0.8885
693	GOE	0.8884
694	52C	0.8884
695	3HM	0.8883
696	NLA	0.8882
697	K32	0.8881
698	IFL	0.8879
699	AX7	0.8879
700	JBH	0.8878
701	54G	0.8878
702	DHC	0.8878
703	KJ5	0.8876
704	JRB	0.8876
705	TH7	0.8875
706	OSB	0.8875
707	ES1	0.8874
708	5Q0	0.8874
709	DHK	0.8874
710	PXM	0.8874
711	HA7	0.8874
712	HPT	0.8873
713	HQY	0.8873
714	O72	0.8873
715	PX7	0.8872
716	AKH	0.8872
717	IPB	0.8872
718	JUG	0.8869
719	4AN	0.8869
720	FHC	0.8868
721	GLO	0.8867
722	7VP	0.8867
723	NBG	0.8865
724	NOY	0.8865
725	2MI	0.8863
726	LL1	0.8863
727	NCT	0.8862
728	IBM	0.8861
729	3ID	0.8861
730	PDC	0.8860
731	0F9	0.8860
732	173	0.8860
733	HJP	0.8859
734	5MK	0.8859
735	1XM	0.8859
736	141	0.8858
737	CHQ	0.8858
738	4YS	0.8857
739	5V7	0.8857
740	RA7	0.8855
741	X09	0.8855
742	64E	0.8855
743	54Z	0.8855
744	PRL	0.8855
745	QMS	0.8854
746	KP2	0.8853
747	CKA	0.8853
748	R6T	0.8853
749	TXW	0.8853
750	PMP	0.8852
751	6BL	0.8851
752	LQ2	0.8850
753	GZ2	0.8849
754	FTV	0.8848
755	57O	0.8848
756	EVF	0.8847
757	CN0	0.8847
758	2JK	0.8847
759	BPN	0.8847
760	CPZ	0.8847
761	0NX	0.8846
762	YH7	0.8845
763	4NM	0.8843
764	5M0	0.8843
765	7VJ	0.8843
766	GVY	0.8842
767	X0T	0.8842
768	M1E	0.8841
769	SWA	0.8840
770	JPZ	0.8839
771	C2U	0.8839
772	PBA	0.8839
773	JCZ	0.8839
774	EJZ	0.8838
775	1LM	0.8838
776	091	0.8837
777	45L	0.8837
778	PHH	0.8836
779	YZM	0.8836
780	A2F	0.8836
781	AMH	0.8835
782	EV3	0.8835
783	DNC	0.8835
784	4NB	0.8834
785	MYJ	0.8833
786	1L5	0.8833
787	6CS	0.8832
788	5RG	0.8831
789	HC4	0.8831
790	YQA	0.8831
791	LYL	0.8830
792	AZG	0.8830
793	4P5	0.8830
794	92G	0.8829
795	GCW	0.8829
796	49O	0.8829
797	M1A	0.8829
798	NPX	0.8829
799	1XA	0.8829
800	HNQ	0.8829
801	21D	0.8828
802	TYR	0.8828
803	M6Z	0.8828
804	AJ1	0.8827
805	692	0.8827
806	PRZ	0.8826
807	N4E	0.8826
808	G1O	0.8825
809	P92	0.8825
810	PPY	0.8825
811	4HM	0.8823
812	N5J	0.8823
813	GT0	0.8823
814	S0G	0.8823
815	2FX	0.8823
816	RD4	0.8821
817	DK1	0.8821
818	F4K	0.8821
819	BHO	0.8821
820	NGW	0.8820
821	NGT	0.8820
822	293	0.8820
823	SYE	0.8819
824	MQB	0.8818
825	NOJ	0.8818
826	J9N	0.8818
827	4FE	0.8818
828	BZE	0.8817
829	SQP	0.8817
830	795	0.8816
831	F1A	0.8816
832	ONR	0.8816
833	I2E	0.8815
834	DUR	0.8815
835	LAO	0.8815
836	AJG	0.8814
837	RVE	0.8814
838	FER	0.8812
839	259	0.8810
840	AY4	0.8810
841	PD2	0.8810
842	TMG	0.8810
843	B0K	0.8809
844	P7Y	0.8809
845	CHB	0.8809
846	774	0.8808
847	DHY	0.8808
848	MAN	0.8807
849	ZZ8	0.8805
850	657	0.8804
851	KLK	0.8804
852	L1O	0.8803
853	8XQ	0.8803
854	OW4	0.8801
855	3RI	0.8800
856	270	0.8799
857	SOE	0.8799
858	TEP	0.8798
859	MUR	0.8798
860	RSV	0.8798
861	X05	0.8797
862	A7N	0.8797
863	P9E	0.8797
864	XQK	0.8796
865	GWM	0.8795
866	HX3	0.8794
867	GOX	0.8794
868	6AP	0.8794
869	P9P	0.8793
870	6HO	0.8791
871	9KZ	0.8790
872	M1Z	0.8790
873	GNY	0.8790
874	CFP	0.8790
875	A5H	0.8789
876	4LW	0.8788
877	4NO	0.8787
878	D2G	0.8787
879	THM	0.8787
880	67X	0.8787
881	36E	0.8786
882	JAE	0.8786
883	2J1	0.8786
884	YRL	0.8785
885	4XH	0.8785
886	EV2	0.8783
887	5WT	0.8782
888	JY2	0.8782
889	FUD	0.8780
890	22L	0.8780
891	KG1	0.8780
892	7WR	0.8780
893	GLA	0.8779
894	K6X	0.8779
895	ISZ	0.8779
896	DIU	0.8778
897	X0V	0.8778
898	G2F	0.8776
899	F31	0.8776
900	X48	0.8773
901	DBX	0.8772
902	12B	0.8771
903	TJM	0.8771
904	2UZ	0.8770
905	FK1	0.8769
906	HH8	0.8769
907	VM1	0.8768
908	CFI	0.8768
909	4WL	0.8767
910	06B	0.8766
911	DMD	0.8765
912	261	0.8765
913	PFL	0.8765
914	QWN	0.8764
915	DX4	0.8764
916	DGJ	0.8764
917	5XL	0.8762
918	5MI	0.8760
919	5F5	0.8760
920	NBV	0.8759
921	YZ9	0.8759
922	HX4	0.8759
923	6HP	0.8757
924	8U3	0.8757
925	BOA	0.8757
926	2QC	0.8757
927	HH5	0.8757
928	L1Q	0.8756
929	JBQ	0.8756
930	290	0.8755
931	18N	0.8754
932	9TW	0.8754
933	ZZT	0.8754
934	4FA	0.8754
935	SN4	0.8753
936	3XR	0.8753
937	NSP	0.8753
938	IPD	0.8751
939	BP7	0.8751
940	R20	0.8751
941	5GT	0.8750
942	11S	0.8750
943	NQH	0.8750
944	5H1	0.8750
945	C53	0.8750
946	F69	0.8749
947	14O	0.8749
948	S7S	0.8749
949	KIF	0.8748
950	4B0	0.8747
951	H4N	0.8747
952	582	0.8747
953	FBG	0.8747
954	LEL	0.8747
955	GCO	0.8746
956	PLP	0.8746
957	G6P	0.8745
958	ZZA	0.8745
959	OXC	0.8745
960	DX1	0.8744
961	QBS	0.8744
962	FP1	0.8744
963	HIS	0.8744
964	EQT	0.8743
965	495	0.8743
966	W8G	0.8742
967	2K4	0.8741
968	IHB	0.8741
969	2B4	0.8741
970	F60	0.8740
971	E3X	0.8740
972	0BP	0.8739
973	LO1	0.8739
974	GTR	0.8738
975	MPK	0.8738
976	GJK	0.8738
977	6GU	0.8738
978	BIK	0.8737
979	TCR	0.8737
980	BSP	0.8736
981	A65	0.8736
982	BZX	0.8736
983	JGB	0.8734
984	G1P	0.8734
985	JVN	0.8733
986	8GK	0.8733
987	S8A	0.8733
988	B2J	0.8733
989	7FU	0.8732
990	R2P	0.8732
991	3VQ	0.8732
992	T1N	0.8731
993	C8O	0.8731
994	LIP	0.8731
995	QWW	0.8731
996	9TZ	0.8730
997	NPA	0.8730
998	PH3	0.8730
999	DCZ	0.8729
1000	1GN	0.8729
1001	QSB	0.8729
1002	QX2	0.8728
1003	39A	0.8727
1004	28S	0.8727
1005	G14	0.8727
1006	4SX	0.8727
1007	HL4	0.8726
1008	PHE	0.8726
1009	3AE	0.8726
1010	P81	0.8726
1011	YSO	0.8726
1012	FBM	0.8725
1013	36Y	0.8724
1014	PHU	0.8723
1015	L14	0.8722
1016	4VY	0.8722
1017	S7J	0.8722
1018	IFP	0.8721
1019	XCG	0.8720
1020	NGO	0.8719
1021	4ZA	0.8718
1022	MXD	0.8718
1023	TAG	0.8717
1024	JXT	0.8717
1025	9H2	0.8717
1026	EPR	0.8717
1027	3VS	0.8717
1028	K5W	0.8717
1029	NTZ	0.8717
1030	K4V	0.8716
1031	LUM	0.8716
1032	BNL	0.8716
1033	5TZ	0.8715
1034	FDK	0.8713
1035	ORO	0.8713
1036	M6P	0.8713
1037	QXW	0.8711
1038	6M9	0.8711
1039	1ZC	0.8710
1040	VC2	0.8710
1041	PZI	0.8710
1042	39U	0.8710
1043	HMU	0.8709
1044	FGZ	0.8709
1045	TRP	0.8708
1046	ES9	0.8706
1047	6AI	0.8705
1048	6L6	0.8705
1049	MT0	0.8705
1050	GIV	0.8704
1051	5MB	0.8703
1052	RKV	0.8703
1053	8OZ	0.8703
1054	GC2	0.8702
1055	535	0.8702
1056	Y0V	0.8701
1057	372	0.8700
1058	HRD	0.8699
1059	L7T	0.8698
1060	JY4	0.8697
1061	GI1	0.8696
1062	GIM	0.8696
1063	D9Z	0.8696
1064	1U6	0.8696
1065	DOR	0.8695
1066	ADA	0.8694
1067	KGK	0.8694
1068	GB4	0.8694
1069	HZQ	0.8693
1070	PUE	0.8692
1071	UFV	0.8692
1072	P80	0.8692
1073	M5N	0.8690
1074	UEG	0.8690
1075	0CU	0.8690
1076	QSH	0.8690
1077	BCP	0.8690
1078	GCV	0.8689
1079	J01	0.8689
1080	PAB	0.8687
1081	EKZ	0.8686
1082	2PV	0.8686
1083	XM0	0.8685
1084	QQQ	0.8684
1085	2J2	0.8683
1086	23J	0.8683
1087	B1J	0.8682
1088	KOJ	0.8682
1089	9PY	0.8681
1090	E3D	0.8681
1091	HLD	0.8681
1092	61O	0.8681
1093	MBG	0.8680
1094	B52	0.8679
1095	OVP	0.8679
1096	0UL	0.8679
1097	8NY	0.8678
1098	2PK	0.8677
1099	YTX	0.8676
1100	149	0.8676
1101	78Y	0.8675
1102	0OK	0.8675
1103	NPS	0.8674
1104	FIX	0.8674
1105	DXK	0.8674
1106	5OF	0.8674
1107	4A5	0.8674
1108	TPA	0.8674
1109	BNT	0.8673
1110	PQZ	0.8672
1111	AH6	0.8672
1112	IQZ	0.8672
1113	II4	0.8671
1114	Z25	0.8670
1115	PHB	0.8670
1116	1XN	0.8668
1117	FYR	0.8668
1118	NPO	0.8668
1119	F40	0.8665
1120	OCZ	0.8664
1121	56D	0.8664
1122	92O	0.8663
1123	AES	0.8662
1124	MPV	0.8661
1125	0RW	0.8661
1126	BNF	0.8661
1127	E1P	0.8660
1128	24B	0.8658
1129	LR5	0.8656
1130	M02	0.8656
1131	GOJ	0.8655
1132	2SX	0.8655
1133	LSA	0.8655
1134	MUK	0.8655
1135	G6D	0.8653
1136	6R8	0.8652
1137	HJ7	0.8652
1138	GAF	0.8651
1139	6TZ	0.8651
1140	Z82	0.8650
1141	82I	0.8649
1142	2FG	0.8648
1143	TR4	0.8647
1144	7O4	0.8646
1145	GYE	0.8646
1146	4HB	0.8646
1147	1VK	0.8646
1148	PZM	0.8646
1149	2D3	0.8644
1150	EYK	0.8644
1151	DE5	0.8642
1152	CNI	0.8642
1153	QNA	0.8641
1154	GAB	0.8641
1155	CSN	0.8640
1156	VC3	0.8640
1157	EWG	0.8640
1158	5VJ	0.8638
1159	3FH	0.8637
1160	6SD	0.8635
1161	XQG	0.8635
1162	BMA	0.8630
1163	XXP	0.8630
1164	96R	0.8630
1165	717	0.8630
1166	9UG	0.8629
1167	GXL	0.8628
1168	AMG	0.8627
1169	P72	0.8627
1170	174	0.8626
1171	D1X	0.8626
1172	H4B NO	0.8626
1173	3NT	0.8626
1174	4NZ	0.8625
1175	Q0K	0.8625
1176	ST4	0.8624
1177	ODK	0.8623
1178	6M1	0.8623
1179	DHR	0.8623
1180	9NB	0.8622
1181	1WC	0.8622
1182	78U	0.8621
1183	P4L	0.8619
1184	GRE	0.8619
1185	9CE	0.8618
1186	25W	0.8617
1187	AW5	0.8616
1188	JA5	0.8616
1189	CTN	0.8615
1190	WUB	0.8615
1191	CKU	0.8613
1192	96U	0.8612
1193	4CS	0.8611
1194	YO5	0.8609
1195	F05	0.8609
1196	TQU	0.8608
1197	OMD	0.8608
1198	TBS	0.8607
1199	BY5	0.8606
1200	X6X	0.8605
1201	0GZ	0.8605
1202	5VU	0.8601
1203	PBZ	0.8601
1204	AAN	0.8600
1205	3HB	0.8598
1206	EZL	0.8598
1207	1DR	0.8597
1208	3XH	0.8595
1209	NRA	0.8595
1210	9FH	0.8594
1211	A13	0.8593
1212	STT	0.8593
1213	NPY	0.8592
1214	JFJ	0.8591
1215	F12	0.8590
1216	PO6	0.8588
1217	4FH	0.8588
1218	L15	0.8587
1219	2D2	0.8586
1220	DC5	0.8586
1221	8D6	0.8585
1222	2BX	0.8583
1223	QUZ	0.8583
1224	P1J	0.8582
1225	RMN	0.8582
1226	6M4	0.8581
1227	DAH	0.8579
1228	1WG	0.8579
1229	5F8	0.8577
1230	2CQ	0.8572
1231	GLY PRO	0.8570
1232	6F0	0.8570
1233	2LP	0.8568
1234	IPT	0.8568
1235	A5P	0.8566
1236	JLZ	0.8566
1237	6DP	0.8565
1238	KTA	0.8563
1239	OVV	0.8563
1240	DX2	0.8561
1241	K17	0.8561
1242	KBZ	0.8561
1243	XXR	0.8560
1244	WCE	0.8559
1245	3AB	0.8555
1246	SWX	0.8553
1247	4MA	0.8553
1248	LP8	0.8553
1249	MMS	0.8550
1250	27K	0.8550
1251	8GC	0.8550
1252	PIY	0.8548
1253	QIC	0.8548
1254	HLR	0.8546
1255	MHK	0.8545
1256	HBD	0.8545
1257	39Z	0.8543
1258	SVN	0.8543
1259	IQ5	0.8543
1260	1DW	0.8541
1261	1Y6	0.8539
1262	2CK	0.8535
1263	L13	0.8534
1264	MT8	0.8533
1265	4FF	0.8532
1266	AC6	0.8529
1267	4JC	0.8529
1268	FA3	0.8528
1269	FSW	0.8527
1270	M3F	0.8527
1271	YIO	0.8524
1272	53C	0.8520
1273	9EW	0.8518
1274	CP6	0.8506

Ligand no: 2; Ligand: SAN; Similar ligands found: 958

No:	Ligand	Similarity coefficient
1	TSU	1.0000
2	AMS	1.0000
3	AAS	1.0000
4	FCR	0.9961
5	1SA	0.9772
6	EKZ	0.9759
7	AC6	0.9735
8	IFP	0.9716
9	OTR	0.9715
10	4SX	0.9715
11	X0V	0.9703
12	HDH	0.9685
13	PMB	0.9680
14	HBD	0.9664
15	PHB	0.9657
16	4FH	0.9651
17	PBZ	0.9648
18	NPO	0.9646
19	SW7	0.9644
20	PAB	0.9644
21	4MA	0.9613
22	1Y6	0.9607
23	826	0.9593
24	Z82	0.9582
25	1DV	0.9572
26	8K2	0.9569
27	P72	0.9549
28	174	0.9543
29	HPS	0.9524
30	FBV	0.9521
31	PEP	0.9515
32	RHU	0.9505
33	3SL	0.9469
34	152	0.9467
35	FB1	0.9467
36	QMP	0.9441
37	DHB	0.9439
38	SPV	0.9428
39	4P5	0.9425
40	INO	0.9418
41	ANN	0.9417
42	FBW	0.9414
43	PNZ	0.9414
44	JLZ	0.9412
45	AMH	0.9405
46	HBA	0.9405
47	S7J	0.9399
48	8OZ	0.9394
49	4NC	0.9394
50	36E	0.9393
51	UFV	0.9391
52	NNO	0.9391
53	HHH	0.9390
54	QY9	0.9388
55	CFI	0.9388
56	MYJ	0.9383
57	GZ3	0.9381
58	A09	0.9379
59	4NM	0.9378
60	4LR	0.9377
61	SN4	0.9376
62	P9P	0.9375
63	E5X	0.9375
64	IPB	0.9371
65	ISZ	0.9370
66	RSO	0.9370
67	BHA	0.9369
68	4A3	0.9365
69	173	0.9365
70	DOB	0.9364
71	FA0	0.9363
72	6M4	0.9363
73	XCZ	0.9359
74	K5W	0.9359
75	AEF	0.9358
76	4M0	0.9354
77	FEH	0.9354
78	5CU	0.9354
79	BNS	0.9353
80	FHB	0.9348
81	BEZ	0.9345
82	XXG	0.9344
83	BEN	0.9343
84	2HO	0.9342
85	LNR	0.9339
86	4BZ	0.9338
87	YRL	0.9335
88	4FA	0.9333
89	GJZ	0.9333
90	RMN	0.9332
91	3AE	0.9332
92	93K	0.9328
93	XX2	0.9323
94	PAC	0.9320
95	3HM	0.9320
96	4VY	0.9319
97	9TW	0.9318
98	TPA	0.9316
99	CHB	0.9313
100	NCA	0.9312
101	BPN	0.9311
102	F1A	0.9311
103	LR5	0.9310
104	GP9	0.9310
105	4HP	0.9310
106	GWM	0.9308
107	BAM	0.9307
108	FBF	0.9303
109	NTN	0.9302
110	51R	0.9301
111	PBC	0.9301
112	SS1	0.9299
113	VGL	0.9296
114	2FY	0.9296
115	PEQ	0.9294
116	0V5	0.9294
117	2AQ	0.9293
118	4VP	0.9292
119	MAJ	0.9292
120	B85	0.9291
121	GUA	0.9287
122	DS0	0.9286
123	IHB	0.9285
124	I3E	0.9284
125	SVD	0.9281
126	03V	0.9280
127	4ZA	0.9279
128	GLN	0.9278
129	7WG	0.9277
130	RNT	0.9276
131	NIO	0.9274
132	R67	0.9273
133	QSB	0.9272
134	4WL	0.9272
135	13P	0.9271
136	SYC	0.9266
137	AEG	0.9265
138	3PG	0.9264
139	6PC	0.9264
140	XM0	0.9263
141	HIO	0.9262
142	TYL	0.9260
143	IP8	0.9254
144	5NU	0.9252
145	RBJ	0.9252
146	7N0	0.9249
147	PGH	0.9248
148	SS2	0.9246
149	8WO	0.9245
150	MUC	0.9244
151	QSC	0.9243
152	92K	0.9241
153	PO6	0.9240
154	SMN	0.9237
155	FBT	0.9237
156	I1E	0.9235
157	1GP	0.9231
158	AX7	0.9230
159	PZM	0.9227
160	PHU	0.9226
161	BHO	0.9226
162	H42	0.9225
163	COU	0.9223
164	MSR	0.9223
165	NBZ	0.9222
166	NM3	0.9220
167	NM2	0.9220
168	AC0	0.9219
169	UNU	0.9219
170	AL0	0.9218
171	6NT	0.9218
172	259	0.9217
173	9RW	0.9217
174	4FS	0.9211
175	2IT	0.9211
176	GGL	0.9211
177	GLU	0.9211
178	4JM	0.9210
179	4JL	0.9209
180	YCP	0.9209
181	ABV	0.9206
182	4AA	0.9203
183	5OB	0.9202
184	23J	0.9201
185	BE7	0.9200
186	FBA	0.9196
187	ZXD	0.9195
188	3NY	0.9195
189	H8N	0.9193
190	HNK	0.9192
191	F9P	0.9190
192	PZA	0.9190
193	HC4	0.9190
194	NIZ	0.9189
195	MNN	0.9189
196	BZ3	0.9187
197	3FH	0.9186
198	JB5	0.9184
199	GRO	0.9181
200	DHK	0.9180
201	6NI	0.9180
202	0HO	0.9180
203	1F1	0.9179
204	M4T	0.9179
205	LMR	0.9179
206	ES5	0.9176
207	2HU	0.9176
208	F60	0.9175
209	EDR	0.9174
210	14O	0.9174
211	5H1	0.9172
212	C2B	0.9171
213	AM4	0.9171
214	2K4	0.9171
215	JZ7	0.9168
216	GVM	0.9163
217	MS9	0.9163
218	4CM	0.9163
219	OCH	0.9162
220	2MI	0.9162
221	TH7	0.9161
222	L99	0.9161
223	CCD	0.9157
224	FQI	0.9157
225	MXN	0.9157
226	5MI	0.9157
227	HFA	0.9157
228	3PF	0.9156
229	11S	0.9156
230	ET2	0.9156
231	ODO	0.9155
232	5NI	0.9154
233	717	0.9153
234	270	0.9153
235	EVF	0.9153
236	LT2	0.9153
237	CXP	0.9153
238	CHH	0.9152
239	TZF	0.9152
240	K34	0.9151
241	SNU	0.9150
242	FA1	0.9150
243	2PG	0.9147
244	Q07	0.9147
245	DPN	0.9146
246	JAE	0.9146
247	DHR	0.9145
248	6RQ	0.9142
249	FBM	0.9142
250	M3H	0.9142
251	PAH	0.9141
252	PC	0.9141
253	FBB	0.9141
254	ES2	0.9141
255	XIY	0.9141
256	URO	0.9140
257	PGA	0.9139
258	0HN	0.9137
259	1DJ	0.9137
260	449	0.9136
261	6AI	0.9136
262	M58	0.9135
263	HG3	0.9135
264	S2G	0.9135
265	DGN	0.9135
266	2HG	0.9135
267	VGD	0.9133
268	SEP	0.9131
269	DHS	0.9130
270	HF2	0.9130
271	Q02	0.9129
272	RB5	0.9129
273	XYL	0.9129
274	ASO	0.9124
275	258	0.9124
276	2ZM	0.9123
277	5MB	0.9123
278	F4E	0.9122
279	36R	0.9122
280	BZ2	0.9120
281	1P8	0.9119
282	LDP	0.9118
283	RNS	0.9116
284	OAA	0.9116
285	6FZ	0.9115
286	3ID	0.9114
287	URS	0.9113
288	GPJ	0.9111
289	GPF	0.9111
290	CPZ	0.9111
291	CXF	0.9110
292	CLW	0.9110
293	E7Z	0.9110
294	K7M	0.9109
295	SPA	0.9109
296	5WV	0.9107
297	1DQ	0.9106
298	K2T	0.9106
299	P92	0.9106
300	FAN	0.9105
301	MLT	0.9103
302	AKG	0.9103
303	5QY	0.9102
304	PIM	0.9102
305	HL5	0.9100
306	WOT	0.9100
307	3QM	0.9099
308	40E	0.9098
309	KBB	0.9097
310	PIY	0.9097
311	HMH	0.9096
312	5XC	0.9096
313	BZX	0.9096
314	ABI	0.9094
315	SKM	0.9093
316	TLA	0.9092
317	B3U	0.9092
318	DYA	0.9091
319	TYE	0.9090
320	E4P	0.9089
321	ASC	0.9089
322	COI	0.9089
323	SRT	0.9088
324	DE5	0.9086
325	2FT	0.9085
326	4JE	0.9084
327	G3H	0.9084
328	G3P	0.9084
329	XUL	0.9083
330	GDE	0.9082
331	24B	0.9081
332	5VM	0.9081
333	TAG	0.9079
334	XQ0	0.9076
335	DHI	0.9075
336	HHI	0.9075
337	LTL	0.9073
338	67N	0.9073
339	DHY	0.9072
340	DMD	0.9072
341	N2I	0.9072
342	Z13	0.9072
343	3A9	0.9071
344	HY1	0.9070
345	D48	0.9070
346	C1M	0.9068
347	SOL	0.9068
348	BE2	0.9067
349	NF3	0.9067
350	DBX	0.9063
351	2CK	0.9063
352	4JQ	0.9063
353	3OC	0.9063
354	FK8	0.9062
355	AES	0.9061
356	3U4	0.9060
357	2AL	0.9059
358	SHA	0.9059
359	4Z4	0.9057
360	H4N	0.9053
361	FK1	0.9052
362	YPN	0.9051
363	97T	0.9049
364	APG	0.9048
365	MZW	0.9048
366	BP9	0.9048
367	SAL	0.9047
368	G3E	0.9047
369	OK7	0.9047
370	ICB	0.9046
371	4NB	0.9045
372	NPY	0.9045
373	RAT	0.9044
374	8ZE	0.9044
375	ES9	0.9044
376	HNL	0.9043
377	3BU	0.9043
378	JAW	0.9042
379	J9Q	0.9042
380	3YP	0.9042
381	ES7	0.9039
382	CN0	0.9038
383	2BG	0.9035
384	SYV	0.9032
385	M1A	0.9032
386	4XV	0.9031
387	1M2	0.9030
388	QUZ	0.9030
389	L14	0.9029
390	BDP	0.9029
391	ASP	0.9028
392	MQN	0.9028
393	SE2	0.9028
394	TEO	0.9026
395	4SV	0.9025
396	HMU	0.9025
397	TGX	0.9024
398	3SK	0.9024
399	3HB	0.9022
400	5QX	0.9022
401	A7N	0.9020
402	4XR	0.9020
403	52C	0.9019
404	J5I	0.9019
405	NSP	0.9019
406	R9S	0.9019
407	2A9	0.9019
408	JDN	0.9018
409	PEA	0.9018
410	A13	0.9016
411	KOJ	0.9016
412	S0E	0.9015
413	MR1	0.9014
414	4XS	0.9014
415	KKN	0.9014
416	BCU	0.9014
417	IT2	0.9013
418	9R5	0.9012
419	8H8	0.9012
420	URP	0.9011
421	JKE	0.9010
422	TTL	0.9010
423	86J	0.9009
424	SKA	0.9008
425	KJH	0.9006
426	VNJ	0.9006
427	14J	0.9005
428	7W4	0.9004
429	ES6	0.9004
430	JB8	0.9003
431	EYK	0.9003
432	3AB	0.9003
433	264	0.9003
434	GAB	0.9003
435	FUD	0.9002
436	NCT	0.8999
437	LPK	0.8999
438	271	0.8998
439	PHE	0.8998
440	HX3	0.8995
441	PSJ	0.8994
442	36Y	0.8994
443	IP0	0.8994
444	3HA	0.8993
445	FBU	0.8992
446	5LA	0.8991
447	PZI	0.8991
448	FYU	0.8990
449	HSO	0.8990
450	BPW	0.8988
451	JA8	0.8988
452	SD4	0.8988
453	7W1	0.8987
454	PEL	0.8986
455	MJ2	0.8986
456	4CS	0.8986
457	FGZ	0.8985
458	8NY	0.8984
459	NDH	0.8984
460	MTL	0.8983
461	ISN	0.8983
462	SYM	0.8982
463	SNO	0.8982
464	CCE	0.8981
465	94W	0.8980
466	A5E	0.8979
467	X1S	0.8978
468	12Q	0.8975
469	4JT	0.8974
470	PSE	0.8973
471	OGA	0.8971
472	DAS	0.8970
473	OVV	0.8967
474	0TU	0.8967
475	MRZ	0.8967
476	4YO	0.8965
477	PEZ	0.8965
478	53C	0.8964
479	B40	0.8962
480	RTK	0.8960
481	ASN	0.8960
482	RBL	0.8958
483	JBE	0.8958
484	3F0	0.8957
485	I4B	0.8956
486	7WV	0.8956
487	LQ2	0.8954
488	KMH	0.8953
489	42J	0.8953
490	J9N	0.8952
491	HCI	0.8952
492	TAR	0.8951
493	6OT	0.8951
494	3NT	0.8950
495	HGA	0.8950
496	PMF	0.8950
497	QSH	0.8949
498	DBH	0.8948
499	HIS	0.8945
500	5HN	0.8945
501	CTL	0.8944
502	ICO	0.8944
503	88L	0.8943
504	DIN	0.8940
505	54D	0.8940
506	NYL	0.8939
507	F9Y	0.8938
508	AHB	0.8937
509	PBA	0.8937
510	TIU	0.8935
511	6M9	0.8933
512	CWJ	0.8933
513	3S5	0.8933
514	ALE	0.8931
515	XDE	0.8931
516	H4E	0.8931
517	1WD	0.8930
518	0JD	0.8930
519	KTA	0.8929
520	MWP	0.8929
521	RJY	0.8929
522	PRO	0.8924
523	ESX	0.8923
524	HQT	0.8922
525	8GC	0.8922
526	ZZT	0.8921
527	RNO	0.8920
528	BSX	0.8920
529	ADA	0.8919
530	UA5	0.8919
531	N2Z	0.8919
532	3C4	0.8918
533	ALA ALA	0.8916
534	OHP	0.8915
535	ESP	0.8914
536	CEE	0.8912
537	EXD	0.8912
538	9FL	0.8912
539	PKU	0.8912
540	M2K	0.8910
541	BNF	0.8909
542	2HQ	0.8908
543	A7W	0.8907
544	PH3	0.8907
545	LEU	0.8907
546	6ME	0.8905
547	REL	0.8903
548	T9G	0.8900
549	NMJ	0.8899
550	0OC	0.8896
551	WCE	0.8896
552	3BZ	0.8896
553	HHA	0.8894
554	IFL	0.8893
555	S24	0.8892
556	15E	0.8892
557	GZQ	0.8892
558	FBJ	0.8890
559	EA1	0.8890
560	C21	0.8886
561	B57	0.8885
562	IDM	0.8884
563	SIN	0.8884
564	TZL	0.8882
565	ZBT	0.8882
566	SOR	0.8878
567	M45	0.8878
568	KDV	0.8876
569	3M0	0.8876
570	15N	0.8875
571	TP5	0.8875
572	J9T	0.8873
573	069	0.8872
574	B09	0.8872
575	1PT	0.8872
576	XBT	0.8871
577	CCU	0.8870
578	KVP	0.8869
579	LLQ	0.8868
580	FA3	0.8867
581	KTJ	0.8867
582	SJ5	0.8864
583	2LP	0.8862
584	BEA	0.8862
585	4PN	0.8861
586	IV2	0.8858
587	8U3	0.8858
588	A29	0.8857
589	1P3	0.8856
590	FP1	0.8856
591	DEN	0.8855
592	P9E	0.8854
593	KJU	0.8854
594	5GU	0.8854
595	JBK	0.8853
596	MEQ	0.8850
597	F05	0.8850
598	9CA	0.8849
599	OKG	0.8847
600	N4B	0.8845
601	5SG	0.8844
602	3PP	0.8844
603	0BP	0.8844
604	MZT	0.8841
605	VNL	0.8840
606	2O6	0.8839
607	2BX	0.8839
608	IWT	0.8839
609	535	0.8838
610	9RH	0.8838
611	CTS	0.8838
612	GTR	0.8837
613	MRW	0.8837
614	EN1	0.8837
615	2HC	0.8837
616	R9Y	0.8837
617	5WZ	0.8835
618	DGL	0.8834
619	J6W	0.8834
620	EUE	0.8834
621	ABN	0.8834
622	BRT	0.8833
623	HQJ	0.8832
624	OVM	0.8832
625	36M	0.8832
626	RUY	0.8832
627	NOY	0.8831
628	IND	0.8831
629	DGJ	0.8830
630	PXL	0.8830
631	G2F	0.8828
632	GLO	0.8828
633	RM1	0.8821
634	IAC	0.8821
635	PPY	0.8821
636	E7S	0.8820
637	BZI	0.8819
638	LZ1	0.8819
639	AT3	0.8819
640	PRA	0.8819
641	XLS	0.8818
642	GCU	0.8817
643	428	0.8817
644	NOJ	0.8816
645	GYE	0.8816
646	E0O	0.8816
647	1P7	0.8814
648	1MR	0.8813
649	1LN	0.8813
650	UY7	0.8812
651	XRG	0.8811
652	1IT	0.8810
653	1Z6	0.8810
654	ILE	0.8808
655	7MU	0.8805
656	UNJ	0.8804
657	HYP	0.8803
658	PYF	0.8800
659	GVG	0.8799
660	RUJ	0.8799
661	265	0.8797
662	F31	0.8797
663	3HP	0.8796
664	0RW	0.8795
665	12T	0.8792
666	HBX	0.8792
667	5Q0	0.8792
668	AMC	0.8791
669	KUF	0.8791
670	CRN	0.8791
671	TYR	0.8791
672	IOM	0.8791
673	G4D	0.8790
674	5RN	0.8788
675	LDU	0.8787
676	FOA	0.8786
677	GLY GLY	0.8786
678	CYX	0.8786
679	EGR	0.8785
680	0P6	0.8785
681	SYG	0.8784
682	QIC	0.8784
683	JZ5	0.8783
684	TZC	0.8782
685	HL4	0.8782
686	2D0	0.8782
687	R2B	0.8781
688	3DM	0.8781
689	9EW	0.8780
690	0FN	0.8780
691	GZL	0.8780
692	IZC	0.8780
693	8CM	0.8779
694	45L	0.8778
695	GLC	0.8778
696	4TU	0.8776
697	9ZE	0.8775
698	SVN	0.8774
699	BNL	0.8773
700	E1T	0.8773
701	2MH	0.8773
702	SYN	0.8772
703	FDB	0.8772
704	FHC	0.8771
705	6F0	0.8771
706	PCA	0.8771
707	3HG	0.8770
708	2F6	0.8770
709	JTH	0.8770
710	GRE	0.8770
711	SOE	0.8770
712	PCR	0.8767
713	BGC	0.8766
714	1SQ	0.8765
715	5XB	0.8764
716	1SH	0.8764
717	F4K	0.8764
718	6M1	0.8764
719	2PC	0.8764
720	JBN	0.8763
721	HLR	0.8763
722	GTQ	0.8761
723	1X4	0.8759
724	HNH	0.8759
725	BZF	0.8759
726	5B1	0.8759
727	282	0.8758
728	OHG	0.8758
729	PLU	0.8758
730	60P	0.8757
731	0R1	0.8757
732	PRF	0.8756
733	PY7	0.8755
734	DQA	0.8755
735	LAO	0.8755
736	L5V	0.8753
737	HQE	0.8751
738	CWS	0.8751
739	MPI	0.8751
740	24W	0.8751
741	DA4	0.8751
742	2AS	0.8751
743	S8V	0.8749
744	SMV	0.8748
745	BML	0.8748
746	JF6	0.8747
747	MNM	0.8747
748	GCB	0.8747
749	129	0.8747
750	TZE	0.8746
751	7VP	0.8745
752	R1P	0.8745
753	4YS	0.8744
754	M6N	0.8744
755	KGK	0.8743
756	SME	0.8743
757	PPT	0.8742
758	M1Q	0.8742
759	091	0.8742
760	PYJ	0.8741
761	I3A	0.8741
762	5AC	0.8741
763	SKF	0.8741
764	1DW	0.8740
765	AJ2	0.8739
766	DA1	0.8739
767	HSM	0.8739
768	QBK	0.8739
769	261	0.8739
770	86L	0.8739
771	Q88	0.8738
772	PRS	0.8737
773	AHR	0.8737
774	1LQ	0.8736
775	44V	0.8734
776	FUM	0.8734
777	5IQ	0.8733
778	FPI	0.8733
779	GBD	0.8731
780	PXY	0.8731
781	1DU	0.8730
782	GAG	0.8730
783	PLQ	0.8730
784	EVA	0.8730
785	5RG	0.8729
786	NBE	0.8729
787	ES1	0.8726
788	M5K	0.8725
789	0CT	0.8721
790	AZ8	0.8721
791	3ZB	0.8720
792	B62	0.8718
793	273	0.8717
794	J9W	0.8716
795	HX2	0.8716
796	MAE	0.8716
797	25R	0.8716
798	MET	0.8715
799	FOM	0.8715
800	OW4	0.8713
801	GVH	0.8713
802	JZ9	0.8713
803	4JP	0.8713
804	ROI	0.8713
805	4HC	0.8712
806	JZ4	0.8710
807	2QC	0.8710
808	GXY	0.8709
809	NK	0.8709
810	MAH	0.8708
811	B24	0.8708
812	LG4	0.8707
813	XAN	0.8706
814	N5J	0.8705
815	6KT	0.8705
816	JPZ	0.8702
817	M6W	0.8702
818	SWA	0.8702
819	ES0	0.8701
820	PYC	0.8699
821	HQY	0.8698
822	N3W	0.8698
823	AQO	0.8696
824	4HS	0.8696
825	9DG	0.8695
826	9TZ	0.8695
827	6GU	0.8693
828	C2Y	0.8691
829	OXQ	0.8691
830	5RO	0.8690
831	4JU	0.8690
832	4BL	0.8688
833	PE0	0.8688
834	MCT	0.8687
835	OXZ	0.8686
836	HQD	0.8685
837	DX4	0.8685
838	4BY	0.8685
839	X6X	0.8684
840	L7T	0.8683
841	CWM	0.8682
842	MEW	0.8682
843	QBM	0.8681
844	RIB	0.8680
845	HX4	0.8679
846	CH9	0.8677
847	CIT	0.8677
848	1WC	0.8677
849	0R0	0.8676
850	JFJ	0.8675
851	D1X	0.8675
852	DX3	0.8674
853	HH5	0.8674
854	6TZ	0.8673
855	TH0	0.8673
856	AZ9	0.8673
857	OTW	0.8671
858	R20	0.8669
859	4JN	0.8669
860	2EC	0.8668
861	B53	0.8667
862	ORO	0.8667
863	SLS	0.8664
864	5M0	0.8662
865	UN1	0.8661
866	23A	0.8660
867	3V4	0.8659
868	DOR	0.8659
869	4CH	0.8657
870	DFB	0.8656
871	OMD	0.8656
872	9FE	0.8655
873	54G	0.8655
874	APY	0.8654
875	AZA	0.8654
876	4XH	0.8653
877	WBU	0.8651
878	A2F	0.8650
879	2ZV	0.8648
880	1A7	0.8647
881	3Z8	0.8647
882	GLL	0.8646
883	K97	0.8645
884	ENO	0.8644
885	ADE	0.8642
886	HA5	0.8642
887	GUN	0.8639
888	TSS	0.8637
889	GAL	0.8634
890	TWO	0.8634
891	HSE	0.8633
892	4HM	0.8633
893	PFL	0.8632
894	XIZ	0.8631
895	ESI	0.8631
896	GLA	0.8628
897	DVQ	0.8628
898	9CL	0.8628
899	URC	0.8628
900	8WT	0.8626
901	IOS	0.8626
902	G3F	0.8623
903	PRZ	0.8622
904	AHC	0.8621
905	Y4L	0.8620
906	PG3	0.8620
907	TCA	0.8619
908	XHP	0.8617
909	8XL	0.8614
910	OXC	0.8613
911	1NP	0.8613
912	G5V	0.8611
913	LSA	0.8610
914	JZ3	0.8609
915	GAF	0.8606
916	34D	0.8604
917	MPV	0.8602
918	IOL	0.8599
919	0F9	0.8597
920	ONR	0.8596
921	2CL	0.8595
922	GXL	0.8593
923	PJW	0.8592
924	AZM	0.8591
925	NVU	0.8591
926	PA1	0.8588
927	QX4	0.8587
928	VXX	0.8584
929	OPE	0.8583
930	H62	0.8580
931	AN3	0.8579
932	V55	0.8579
933	JND	0.8577
934	7B4	0.8576
935	PQK	0.8575
936	1L5	0.8575
937	ZZZ	0.8573
938	EUG	0.8570
939	TFB	0.8565
940	1MC	0.8564
941	CFA	0.8561
942	SC2	0.8560
943	HPA	0.8555
944	6CS	0.8553
945	3IT	0.8552
946	1KP	0.8552
947	AOT	0.8551
948	8TX	0.8549
949	HXX	0.8549
950	EOL	0.8544
951	TT4	0.8536
952	149	0.8535
953	NAG	0.8530
954	GCS	0.8525
955	KVV	0.8523
956	RSF	0.8523
957	ALL	0.8520
958	NK1	0.8518

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

Pocket No.: 1; Query (leader) PDB : 1AJ0; Ligand: PH2; Similar sites found with APoc: 2

This union binding pocket(no: 1) in the query (biounit: 1aj0.bio1) has 28 residues
No:	Leader PDB	Ligand	Sequence Similarity
1	6JWS	PT1	46.8085
2	6JWS	PT1	46.8085

Pocket No.: 2; Query (leader) PDB : 1AJ0; Ligand: SAN; Similar sites found with APoc: 2

This union binding pocket(no: 2) in the query (biounit: 1aj0.bio1) has 28 residues
No:	Leader PDB	Ligand	Sequence Similarity
1	6JWS	PT1	46.8085
2	6JWS	PT1	46.8085

APoc FAQ