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Receptor

PDB id	Resolution	Class	Description	Source	Keywords
1RRW	2.21 Å	EC: 4.1.2.25	DHNA COMPLEXED WITH 9-METHYLGUANINE	STAPHYLOCOCCUS AUREUS	DHNA COMPLEXED WITH 9-METHYLGUANINE LYASE
Ref.:	DISCOVERY OF POTENT INHIBITORS OF DIHYDRONEOPTERIN USING CRYSTALEAD HIGH-THROUGHPUT X-RAY CRYSTALLOGRA SCREENING AND STRUCTURE-DIRECTED LEAD OPTIMIZATION. J.MED.CHEM. V. 47 1709 2004

Ligand

Ligand	Chain:Residue	Validity	Ligand Warnings	Binding Data	NGL Viewer	Molecular Weight (Da)	Formula	SMILES
9MG	A:1001;	Valid;	none;	ic50 = 28 uM		165.153	C6 H7 N5 O	Cn1cn...

View in 3D viewer

90% Homology Family

Leader

PDB id	Resolution	Class	Description	Source	Keywords
1RSD	2.5 Å	EC: 4.1.2.25	DHNA COMPLEX WITH 3-(5-AMINO-7-HYDROXY-[1,2,3]TRIAZOLO[4,5- D]PYRIMIDIN-2-YL)-N-[2-(2-HYDROXYMETHYL-PHENYLSULFANYL)-BENB ENZAMIDE	STAPHYLOCOCCUS AUREUS	DHNA 78-DIHYDRONEOPTERIN ALDOLASE 3-(5-AMINO-7-HYDROXY-[13]TRIAZOLO[45-D]PYRIMIDIN-2-YL)-N-[2-(2-HYDROXYMETHYL- PHENYLSULFANYL)-BENZYL]-BENZAMIDE LYASE
Ref.:	DISCOVERY OF POTENT INHIBITORS OF DIHYDRONEOPTERIN USING CRYSTALEAD HIGH-THROUGHPUT X-RAY CRYSTALLOGRA SCREENING AND STRUCTURE-DIRECTED LEAD OPTIMIZATION. J.MED.CHEM. V. 47 1709 2004

Members (8)

No:	PDB id	Binding Data	Representative ligand	Formula	Smiles
The Class containing this family consists of a total of 2 families.
1	2NM3	-	MPU	C9 H11 N5 O4	c1c(nc2c(n....
2	1RRW	ic50 = 28 uM	9MG	C6 H7 N5 O	Cn1cnc2c1n....
3	1RSD	ic50 = 0.3 uM	PSB	C25 H21 N7 O3 S	c1ccc(c(c1....
4	2DHN	-	PH2	C7 H9 N5 O2	C1C(=NC2=C....
5	1RRI	ic50 = 1.5 uM	A45	C11 H8 N6 O3	c1cc(cc(c1....
6	1RSI	ic50 = 38 uM	977	C10 H8 Br N3 O	c1ccc(cc1)....
7	2NM2	-	NEU	C9 H11 N5 O4	c1c(nc2c(n....
8	1RS2	ic50 = 50 uM	209	C7 H9 N5 O2	CN1c2c(nc(....

70% Homology Family (8)

No:	PDB id	Binding Data	Representative ligand	Formula	Smiles
The Class containing this family consists of a total of 2 families.
1	2NM3	-	MPU	C9 H11 N5 O4	c1c(nc2c(n....
2	1RRW	ic50 = 28 uM	9MG	C6 H7 N5 O	Cn1cnc2c1n....
3	1RSD	ic50 = 0.3 uM	PSB	C25 H21 N7 O3 S	c1ccc(c(c1....
4	2DHN	-	PH2	C7 H9 N5 O2	C1C(=NC2=C....
5	1RRI	ic50 = 1.5 uM	A45	C11 H8 N6 O3	c1cc(cc(c1....
6	1RSI	ic50 = 38 uM	977	C10 H8 Br N3 O	c1ccc(cc1)....
7	2NM2	-	NEU	C9 H11 N5 O4	c1c(nc2c(n....
8	1RS2	ic50 = 50 uM	209	C7 H9 N5 O2	CN1c2c(nc(....

50% Homology Family (9)

No:	PDB id	Binding Data	Representative ligand	Formula	Smiles
The Class containing this family consists of a total of 2 families.
1	1SQL	-	GUN	C5 H5 N5 O	c1[nH]c2c(....
2	2NM3	-	MPU	C9 H11 N5 O4	c1c(nc2c(n....
3	1RRW	ic50 = 28 uM	9MG	C6 H7 N5 O	Cn1cnc2c1n....
4	1RSD	ic50 = 0.3 uM	PSB	C25 H21 N7 O3 S	c1ccc(c(c1....
5	2DHN	-	PH2	C7 H9 N5 O2	C1C(=NC2=C....
6	1RRI	ic50 = 1.5 uM	A45	C11 H8 N6 O3	c1cc(cc(c1....
7	1RSI	ic50 = 38 uM	977	C10 H8 Br N3 O	c1ccc(cc1)....
8	2NM2	-	NEU	C9 H11 N5 O4	c1c(nc2c(n....
9	1RS2	ic50 = 50 uM	209	C7 H9 N5 O2	CN1c2c(nc(....

Polypharmacology

Similar Ligands (2D)

Ligand no: 1; Ligand: 9MG; Similar ligands found: 1

No:	Ligand	ECFP6 Tc	MDL keys Tc
1	9MG	1	1

Similar Ligands (3D)

Ligand no: 1; Ligand: 9MG; Similar ligands found: 1155

No:	Ligand	Similarity coefficient
1	UNC	0.9851
2	XAN	0.9833
3	3DO	0.9819
4	AZA	0.9819
5	B60	0.9809
6	9DG	0.9807
7	PE0	0.9806
8	IGA	0.9806
9	FOT	0.9803
10	GUN	0.9802
11	AZ8	0.9799
12	UAN	0.9774
13	141	0.9774
14	4HC	0.9767
15	MAQ	0.9766
16	Q24	0.9757
17	MUA	0.9754
18	6AP	0.9751
19	M6N	0.9746
20	290	0.9744
21	6GU	0.9741
22	G3F	0.9741
23	J9W	0.9739
24	A2F	0.9738
25	AJ2	0.9738
26	M1Q	0.9735
27	M5K	0.9734
28	MEW	0.9733
29	AZG	0.9731
30	AQO	0.9731
31	IJZ	0.9730
32	NDM	0.9726
33	BGC	0.9721
34	DBJ	0.9718
35	DX4	0.9717
36	C2U	0.9716
37	D07	0.9713
38	ADZ	0.9713
39	2AK	0.9712
40	HJP	0.9709
41	YH7	0.9708
42	CFP	0.9705
43	1XM	0.9697
44	BOA	0.9693
45	GCS	0.9689
46	8S0	0.9686
47	GLC	0.9673
48	BCP	0.9671
49	1XN	0.9667
50	0CU	0.9664
51	7B4	0.9662
52	KT7	0.9657
53	M0Q	0.9655
54	M0W	0.9646
55	HLZ	0.9645
56	1P7	0.9643
57	M1H	0.9632
58	7VS	0.9627
59	I3A	0.9621
60	OXC	0.9620
61	7VJ	0.9620
62	FDB	0.9618
63	HQY	0.9616
64	ORO	0.9616
65	5RG	0.9610
66	O72	0.9606
67	7HQ	0.9604
68	5SG	0.9603
69	5IQ	0.9599
70	MO8	0.9597
71	JBH	0.9590
72	HH5	0.9589
73	5M0	0.9589
74	N5J	0.9587
75	4YS	0.9586
76	25W	0.9583
77	5Q0	0.9582
78	5B1	0.9582
79	JPZ	0.9580
80	1SQ	0.9580
81	GTQ	0.9575
82	0P6	0.9573
83	ES1	0.9570
84	1LQ	0.9567
85	54G	0.9566
86	LGC	0.9566
87	BDP	0.9565
88	5WX	0.9563
89	B53	0.9561
90	DOR	0.9559
91	1LM	0.9553
92	JBQ	0.9553
93	G6D	0.9552
94	DRL	0.9549
95	URC	0.9544
96	1NP	0.9543
97	CWS	0.9539
98	32X	0.9538
99	9TZ	0.9537
100	6CS	0.9534
101	24W	0.9532
102	SVN	0.9532
103	M1E	0.9531
104	LZM	0.9530
105	5WY	0.9530
106	DIU	0.9528
107	4MU	0.9528
108	7ZE	0.9525
109	KBG	0.9525
110	ALL	0.9525
111	34D	0.9522
112	2MN	0.9522
113	7NI	0.9520
114	DHQ	0.9519
115	AW5	0.9517
116	5MK	0.9514
117	KJY	0.9513
118	3WA	0.9513
119	86J	0.9511
120	QBK	0.9511
121	8CM	0.9509
122	ADK	0.9508
123	CFF	0.9508
124	4XH	0.9506
125	B55	0.9506
126	12B	0.9505
127	TOF	0.9505
128	AZ9	0.9504
129	BTY	0.9503
130	42A	0.9503
131	E7Z	0.9502
132	EA1	0.9502
133	RM1	0.9502
134	3MA	0.9501
135	CTS	0.9498
136	F05	0.9493
137	HPA	0.9490
138	R8V	0.9490
139	HH8	0.9489
140	SAL	0.9486
141	XXR	0.9483
142	KUF	0.9482
143	WOO	0.9480
144	42C	0.9477
145	Q88	0.9475
146	2ZQ	0.9474
147	HHA	0.9474
148	GCU	0.9474
149	9EW	0.9473
150	SX1	0.9472
151	B62	0.9471
152	15L	0.9469
153	8TX	0.9468
154	3IT	0.9467
155	BZX	0.9464
156	ADE	0.9464
157	APZ	0.9463
158	HQD	0.9461
159	2EC	0.9460
160	4CS	0.9459
161	75K	0.9458
162	3F0	0.9458
163	ASO	0.9457
164	5OB	0.9455
165	6M4	0.9453
166	JBK	0.9451
167	HLR	0.9451
168	8IG	0.9449
169	5JQ	0.9448
170	AJV	0.9447
171	Q6T	0.9447
172	9HX	0.9447
173	3Z7	0.9445
174	GCB	0.9445
175	GAL	0.9443
176	NQ	0.9443
177	XHP	0.9438
178	0FO	0.9438
179	BP1	0.9437
180	EQT	0.9437
181	7WA	0.9437
182	6VD	0.9437
183	3HA	0.9437
184	M1A	0.9435
185	COU	0.9435
186	7HP	0.9434
187	XAZ	0.9434
188	RXA	0.9434
189	3Z8	0.9434
190	L3Q	0.9434
191	6AI	0.9433
192	DPZ	0.9433
193	9DA	0.9431
194	F5B	0.9429
195	SHG	0.9429
196	3M0	0.9428
197	BMA	0.9428
198	LT2	0.9427
199	DBH	0.9426
200	AKH	0.9426
201	6MP	0.9424
202	B57	0.9424
203	JBE	0.9424
204	A7W	0.9423
205	CWM	0.9422
206	0RW	0.9421
207	10L	0.9420
208	QPR	0.9419
209	XYP	0.9418
210	SXS	0.9417
211	VK3	0.9414
212	X05	0.9413
213	SWD	0.9413
214	5H1	0.9412
215	2HQ	0.9411
216	6M9	0.9411
217	EVA	0.9411
218	4M4	0.9411
219	44W	0.9408
220	03V	0.9408
221	495	0.9406
222	FE DB1	0.9405
223	3U4	0.9404
224	0W8	0.9404
225	HZQ	0.9403
226	6ME	0.9403
227	BTE	0.9403
228	4Z4	0.9402
229	5RN	0.9401
230	14O	0.9399
231	4HM	0.9399
232	ISN	0.9398
233	LCN	0.9397
234	5MB	0.9394
235	JB5	0.9394
236	MT0	0.9393
237	GAB	0.9393
238	NTZ	0.9393
239	F0J	0.9392
240	X09	0.9392
241	7W4	0.9388
242	0N7	0.9387
243	V55	0.9386
244	2K4	0.9385
245	LSA	0.9385
246	JAE	0.9384
247	F60	0.9383
248	NOJ	0.9383
249	44V	0.9382
250	5JL	0.9379
251	DIN	0.9379
252	4FS	0.9378
253	BE2	0.9378
254	EUG	0.9375
255	3MG	0.9375
256	GCW	0.9375
257	PXL	0.9374
258	QX4	0.9373
259	ES0	0.9371
260	2AQ	0.9371
261	8GC	0.9371
262	G5V	0.9370
263	KIB	0.9370
264	D1X	0.9369
265	JKE	0.9368
266	OCH	0.9368
267	ES5	0.9367
268	YSO	0.9367
269	PYQ	0.9366
270	MRW	0.9365
271	PM6	0.9363
272	5MI	0.9363
273	JUG	0.9363
274	39A	0.9362
275	XQG	0.9362
276	KKN	0.9361
277	92K	0.9361
278	MWP	0.9360
279	NID	0.9358
280	4ME	0.9358
281	3NT	0.9357
282	OTW	0.9356
283	G1O	0.9355
284	Q7A	0.9355
285	ES4	0.9352
286	DQU	0.9351
287	MVN	0.9350
288	GIO	0.9349
289	IFL	0.9349
290	ES9	0.9348
291	7ME	0.9347
292	5HN	0.9347
293	53C	0.9347
294	UEG	0.9346
295	6LW	0.9346
296	4SV	0.9345
297	329	0.9344
298	MAN	0.9342
299	ZVO	0.9341
300	GXY	0.9341
301	RAM	0.9341
302	OA3	0.9340
303	ICO	0.9340
304	AHR	0.9340
305	680	0.9339
306	TEP	0.9339
307	2D0	0.9338
308	ES6	0.9337
309	S76	0.9337
310	3AB	0.9335
311	BZ3	0.9335
312	FYU	0.9335
313	3HB	0.9334
314	NTM	0.9334
315	SRO	0.9329
316	PA1	0.9328
317	1DW	0.9327
318	N8Y	0.9325
319	PHH	0.9323
320	OVV	0.9322
321	MT5	0.9322
322	G2F	0.9322
323	3ID	0.9322
324	OW4	0.9321
325	SJ5	0.9321
326	11S	0.9320
327	3OC	0.9317
328	3MB	0.9316
329	ES7	0.9315
330	5XC	0.9315
331	WCE	0.9315
332	GTR	0.9313
333	JIF	0.9311
334	1WG	0.9310
335	67N	0.9309
336	ISE	0.9309
337	4JT	0.9308
338	BK9	0.9307
339	4ZC	0.9307
340	5WV	0.9306
341	H42	0.9306
342	3BZ	0.9304
343	QX2	0.9304
344	OVM	0.9304
345	6BL	0.9302
346	MBG	0.9300
347	T6C	0.9300
348	1WD	0.9299
349	EXO	0.9299
350	INE	0.9298
351	JXN	0.9296
352	G3E	0.9296
353	2A7	0.9295
354	PHT	0.9294
355	GOX	0.9293
356	ZZ8	0.9292
357	37T	0.9290
358	TH7	0.9289
359	3PF	0.9289
360	H4N	0.9287
361	BRT	0.9286
362	7WV	0.9285
363	QUZ	0.9285
364	GM7	0.9284
365	X8D	0.9282
366	ZWZ	0.9277
367	GJS	0.9277
368	82I	0.9276
369	2CK	0.9275
370	RM4	0.9274
371	5QX	0.9270
372	FK1	0.9269
373	DBX	0.9269
374	DOB	0.9267
375	XQ0	0.9266
376	GYE	0.9264
377	DMD	0.9263
378	150	0.9260
379	7MH	0.9259
380	GRE	0.9259
381	FA0	0.9258
382	QAT	0.9257
383	GDE	0.9257
384	DHK	0.9255
385	INS	0.9254
386	23A	0.9253
387	M2K	0.9252
388	2CQ	0.9252
389	GTZ	0.9250
390	PXM	0.9250
391	KJH	0.9249
392	7W1	0.9249
393	5NU	0.9249
394	GLT	0.9249
395	4VS	0.9248
396	12Q	0.9245
397	PFB	0.9245
398	EJZ	0.9244
399	4NC	0.9244
400	LKA	0.9244
401	YQA	0.9242
402	F12	0.9242
403	NPY	0.9242
404	MR1	0.9241
405	GZ8	0.9238
406	QAS	0.9238
407	J9T	0.9236
408	GOG	0.9233
409	NDH	0.9233
410	SOR	0.9233
411	GT0	0.9232
412	NOY	0.9231
413	HNQ	0.9230
414	BEA	0.9228
415	2H5	0.9228
416	EYK	0.9227
417	3R6	0.9227
418	0LH	0.9227
419	HA7	0.9226
420	KLW	0.9225
421	A13	0.9225
422	FUC	0.9225
423	4M0	0.9224
424	FBG	0.9224
425	CTL	0.9224
426	RNS	0.9222
427	5RO	0.9221
428	1P3	0.9221
429	R8S	0.9219
430	II6	0.9219
431	TTL	0.9217
432	XX2	0.9215
433	TTY	0.9214
434	2AL	0.9214
435	BHA	0.9213
436	HMU	0.9213
437	ASC	0.9213
438	5CU	0.9212
439	2ZV	0.9210
440	7B3	0.9210
441	HMH	0.9209
442	FUL	0.9209
443	8NY	0.9208
444	VNL	0.9207
445	HQT	0.9206
446	RPQ	0.9206
447	F4Z	0.9204
448	IFM	0.9202
449	35C	0.9202
450	JFD	0.9200
451	12M	0.9199
452	YIO	0.9198
453	5QY	0.9198
454	I6G	0.9197
455	HTP	0.9196
456	BHO	0.9195
457	BSP	0.9194
458	FRU	0.9194
459	GLF	0.9194
460	0JD	0.9191
461	PDC	0.9190
462	TC7	0.9188
463	948	0.9188
464	SWA	0.9188
465	209	0.9183
466	GIV	0.9183
467	IV2	0.9182
468	RSF	0.9181
469	JZ3	0.9180
470	KYD	0.9179
471	8ZE	0.9177
472	9KT	0.9176
473	45C	0.9175
474	LFR	0.9175
475	6M1	0.9174
476	1U6	0.9174
477	SHA	0.9173
478	PRZ	0.9173
479	1GN	0.9172
480	6F0	0.9171
481	SE2	0.9171
482	FGZ	0.9171
483	ZZT	0.9170
484	DNC	0.9170
485	39O	0.9170
486	K6X	0.9167
487	5WU	0.9167
488	VOH	0.9165
489	3SK	0.9165
490	FHN	0.9164
491	KJU	0.9163
492	LXC	0.9162
493	PRF	0.9160
494	CLZ	0.9158
495	5NE	0.9158
496	149	0.9158
497	GIM	0.9155
498	CBF	0.9155
499	GBD	0.9153
500	KOJ	0.9153
501	VNJ	0.9147
502	2FG	0.9146
503	D48	0.9146
504	SKA	0.9145
505	M5N	0.9144
506	8WT	0.9144
507	2LY	0.9141
508	8XQ	0.9140
509	J5I	0.9139
510	FP1	0.9136
511	ZZ3	0.9136
512	FH2	0.9136
513	H33	0.9135
514	FCB	0.9134
515	FDK	0.9134
516	XYL	0.9134
517	4AA	0.9133
518	24B	0.9130
519	TBP	0.9129
520	261	0.9129
521	4KL	0.9129
522	NK	0.9128
523	KYA	0.9128
524	3RK	0.9127
525	TFU	0.9127
526	FUF	0.9126
527	Z5P	0.9125
528	AFR	0.9125
529	HFB	0.9123
530	PQ0	0.9122
531	KBB	0.9121
532	RB5	0.9120
533	N2I	0.9120
534	286	0.9119
535	RIB	0.9119
536	1X7	0.9118
537	TSS	0.9117
538	NVU	0.9117
539	OMD	0.9117
540	OVP	0.9116
541	F9Y	0.9114
542	3XX	0.9114
543	AIN	0.9114
544	BCU	0.9114
545	GAG	0.9111
546	MFB	0.9110
547	DIE	0.9110
548	SF9	0.9109
549	ENL	0.9108
550	OXQ	0.9104
551	293	0.9104
552	7WR	0.9100
553	GTL	0.9100
554	36R	0.9099
555	0R0	0.9098
556	92P	0.9097
557	4TU	0.9096
558	GIF	0.9095
559	ADA	0.9094
560	AH8	0.9094
561	BZF	0.9094
562	C2Y	0.9092
563	HLD	0.9091
564	BZI	0.9091
565	AEZ	0.9090
566	URF	0.9088
567	226	0.9087
568	51R	0.9087
569	R8A	0.9086
570	OXZ	0.9086
571	CLW	0.9085
572	LI6	0.9084
573	DEN	0.9083
574	DHB	0.9083
575	2FQ	0.9082
576	5GU	0.9082
577	XLS	0.9082
578	ET2	0.9081
579	KIA	0.9080
580	FLV	0.9079
581	1P8	0.9079
582	MCT	0.9079
583	GVH	0.9077
584	GLA	0.9077
585	DQN	0.9076
586	MNM	0.9074
587	I1N	0.9073
588	HA5	0.9073
589	DMJ	0.9071
590	0CT	0.9070
591	INO	0.9070
592	MYJ	0.9069
593	BCF	0.9069
594	IND	0.9067
595	MWM	0.9065
596	B5D	0.9064
597	23J	0.9063
598	7MU	0.9062
599	H7Y	0.9062
600	MFU	0.9062
601	IDM	0.9061
602	4HO	0.9060
603	P9P	0.9060
604	DNF	0.9060
605	SKM	0.9060
606	4ZE	0.9059
607	A1U	0.9058
608	5CL	0.9058
609	PEY	0.9058
610	9PY	0.9057
611	275	0.9056
612	LRH	0.9056
613	BBF	0.9056
614	AMG	0.9055
615	MPI	0.9054
616	SYV	0.9054
617	0R1	0.9054
618	NSP	0.9054
619	5VM	0.9053
620	TBS	0.9052
621	SOE	0.9052
622	2HO	0.9051
623	1AL	0.9050
624	GLY PRO	0.9050
625	TM7	0.9049
626	UFO	0.9048
627	HY3	0.9047
628	HX3	0.9046
629	WBU	0.9044
630	LZ1	0.9044
631	NNO	0.9043
632	Q71	0.9043
633	XBZ	0.9042
634	BEZ	0.9042
635	QOS	0.9041
636	K17	0.9041
637	3HM	0.9041
638	TSR	0.9040
639	0XT	0.9040
640	2AC	0.9038
641	LDR	0.9038
642	ES2	0.9037
643	O2A	0.9037
644	93K	0.9036
645	UQ	0.9036
646	SVD	0.9036
647	AGK	0.9036
648	9FE	0.9035
649	G4D	0.9034
650	FBB	0.9033
651	JZ9	0.9032
652	EKZ	0.9031
653	3DM	0.9030
654	2MP	0.9029
655	FHB	0.9029
656	4A3	0.9028
657	JKZ	0.9028
658	ABE	0.9028
659	MHK	0.9028
660	0GZ	0.9026
661	A29	0.9025
662	CN0	0.9025
663	TH0	0.9024
664	1KP	0.9024
665	2YU	0.9024
666	069	0.9023
667	0TR	0.9022
668	FBV	0.9021
669	FBU	0.9020
670	9TW	0.9020
671	60P	0.9019
672	XYD	0.9019
673	TVP	0.9019
674	EV0	0.9018
675	PX7	0.9018
676	ICP	0.9017
677	PYD	0.9017
678	ABV	0.9017
679	IPB	0.9017
680	34A	0.9016
681	NMJ	0.9016
682	G12	0.9015
683	4CL	0.9013
684	1MC	0.9013
685	MIG	0.9012
686	TDR	0.9011
687	KP6	0.9011
688	3AL	0.9010
689	18N	0.9010
690	MZG	0.9008
691	GCV	0.9006
692	QWN	0.9005
693	BSX	0.9005
694	F3B	0.9005
695	HT4	0.9004
696	9FL	0.9004
697	K2T	0.9003
698	0TU	0.9003
699	20J	0.9003
700	8OZ	0.9003
701	1PT	0.9003
702	CHB	0.9002
703	4XR	0.9002
704	8H8	0.9000
705	5JC	0.9000
706	4YO	0.8999
707	9AP	0.8996
708	AZF	0.8995
709	K2P	0.8995
710	7CZ	0.8995
711	4JJ	0.8994
712	F31	0.8994
713	8GK	0.8993
714	GAF	0.8993
715	9R5	0.8993
716	XCZ	0.8992
717	XYS	0.8992
718	OTD	0.8992
719	V6F	0.8991
720	P3K	0.8990
721	AJY	0.8990
722	270	0.8989
723	AX7	0.8989
724	KDV	0.8989
725	4TE	0.8989
726	NGO	0.8988
727	CFI	0.8988
728	YCP	0.8987
729	BDF	0.8986
730	173	0.8985
731	IBF	0.8984
732	MQN	0.8984
733	2LP	0.8984
734	DFB	0.8984
735	6PC	0.8984
736	43M	0.8984
737	MWJ	0.8981
738	4JQ	0.8980
739	JZ1	0.8979
740	K3Q	0.8979
741	QWW	0.8977
742	MS9	0.8976
743	JZ2	0.8975
744	1LN	0.8975
745	PCI	0.8975
746	FB1	0.8974
747	GV9	0.8972
748	PD2	0.8972
749	9RW	0.8972
750	091	0.8971
751	TWO	0.8970
752	PZA	0.8968
753	X6X	0.8967
754	PYG	0.8967
755	RIP	0.8966
756	BEN	0.8966
757	MVL	0.8965
758	28N	0.8962
759	NBZ	0.8961
760	27Y	0.8960
761	HKD	0.8960
762	0F9	0.8960
763	3FH	0.8960
764	K22	0.8959
765	0HO	0.8959
766	K32	0.8959
767	HXX	0.8958
768	VGL	0.8957
769	8G0	0.8957
770	AS3	0.8956
771	RD4	0.8956
772	2ZM	0.8956
773	6UA	0.8956
774	7MX	0.8955
775	DX3	0.8955
776	2DR	0.8955
777	JLZ	0.8954
778	DGJ	0.8954
779	H76	0.8953
780	HIS	0.8952
781	BAM	0.8951
782	5AN	0.8951
783	06B	0.8950
784	RMN	0.8950
785	ODO	0.8950
786	13X	0.8950
787	64C	0.8950
788	4XV	0.8949
789	2FY	0.8949
790	H6B	0.8949
791	GZL	0.8949
792	8W9	0.8949
793	FA3	0.8948
794	LNR	0.8948
795	PH2	0.8947
796	0HN	0.8947
797	BR9	0.8946
798	2MI	0.8946
799	NCA	0.8946
800	ROI	0.8941
801	5NS	0.8941
802	VGD	0.8940
803	EOL	0.8939
804	0FK	0.8938
805	NIO	0.8937
806	8VE	0.8937
807	E35	0.8937
808	Q77	0.8935
809	GXL	0.8935
810	5MH	0.8934
811	IHB	0.8934
812	J9Q	0.8934
813	6OT	0.8933
814	7D2	0.8933
815	ABI	0.8932
816	2BG	0.8931
817	N8P	0.8931
818	F81	0.8930
819	MMA	0.8930
820	DFU	0.8930
821	BR8	0.8930
822	TAR	0.8929
823	UNU	0.8927
824	DQA	0.8927
825	1F1	0.8925
826	8HC	0.8923
827	15N	0.8923
828	PRY	0.8922
829	CWJ	0.8921
830	TIU	0.8920
831	5UC	0.8919
832	QSB	0.8919
833	6KX	0.8917
834	FLM	0.8916
835	TLA	0.8914
836	5NI	0.8914
837	GOO	0.8914
838	FCA	0.8913
839	94W	0.8913
840	AX2	0.8913
841	FFP	0.8912
842	ISZ	0.8912
843	P92	0.8911
844	6NT	0.8909
845	PCA	0.8909
846	0MK	0.8908
847	TT4	0.8908
848	2SX	0.8908
849	3NY	0.8906
850	FPK	0.8903
851	UFV	0.8903
852	4JP	0.8900
853	M3S	0.8900
854	DUB	0.8899
855	K5W	0.8898
856	2A9	0.8897
857	NCD	0.8897
858	SYA	0.8896
859	MT8	0.8896
860	HHR	0.8894
861	QSC	0.8894
862	4JO	0.8894
863	FBW	0.8893
864	JXW	0.8893
865	64K	0.8892
866	1XX	0.8891
867	ZZZ	0.8891
868	0FN	0.8891
869	OAA	0.8891
870	47J	0.8890
871	BPU	0.8890
872	3AY	0.8890
873	C9E	0.8888
874	GYP	0.8888
875	2HU	0.8887
876	JXZ	0.8887
877	6NI	0.8887
878	FBT	0.8886
879	WDL	0.8885
880	TGX	0.8884
881	FPY	0.8883
882	3MC	0.8883
883	NTN	0.8882
884	FUB	0.8879
885	ARB	0.8879
886	B2J	0.8876
887	XM0	0.8875
888	TLD	0.8875
889	M2H	0.8874
890	9CA	0.8872
891	XBT	0.8872
892	MBD	0.8870
893	QXW	0.8870
894	ICT	0.8870
895	KFH	0.8870
896	4XS	0.8869
897	PZI	0.8869
898	5ZE	0.8868
899	1IT	0.8866
900	MSN	0.8866
901	3A9	0.8866
902	6RQ	0.8864
903	JU2	0.8863
904	60Q	0.8863
905	J01	0.8863
906	Y8I	0.8861
907	JZ4	0.8861
908	IFP	0.8859
909	YTB	0.8855
910	XIY	0.8853
911	IPZ	0.8852
912	MZB	0.8852
913	NIZ	0.8852
914	NEQ	0.8852
915	K8X	0.8851
916	ERH	0.8851
917	IP0	0.8851
918	ARA	0.8850
919	FDR	0.8847
920	IDH	0.8846
921	2ZX	0.8845
922	97T	0.8845
923	XUL	0.8845
924	SRT	0.8844
925	M4E	0.8841
926	2C9	0.8840
927	2CM	0.8840
928	SF6	0.8840
929	QIC	0.8839
930	R9Y	0.8837
931	95Z	0.8836
932	AC0	0.8833
933	N7P	0.8833
934	PBC	0.8832
935	JTH	0.8832
936	DEE	0.8831
937	6MH	0.8830
938	2MY	0.8830
939	GMN	0.8830
940	ONR	0.8827
941	45L	0.8827
942	ZYR	0.8826
943	1QP	0.8826
944	X0V	0.8825
945	LYL	0.8824
946	LDP	0.8823
947	2TQ	0.8823
948	LZ2	0.8822
949	JAW	0.8820
950	3FA	0.8820
951	IAC	0.8818
952	2PG	0.8817
953	NPO	0.8815
954	H62	0.8814
955	14J	0.8813
956	VXX	0.8813
957	R9S	0.8812
958	X0W	0.8811
959	E1T	0.8810
960	EDR	0.8810
961	8WO	0.8810
962	JND	0.8809
963	6XI	0.8805
964	NLA	0.8804
965	52C	0.8803
966	3C2	0.8803
967	QSH	0.8802
968	3R9	0.8801
969	3CE	0.8798
970	JG8	0.8798
971	RJY	0.8797
972	3C1	0.8796
973	260	0.8794
974	2KA	0.8793
975	GCO	0.8791
976	JYB	0.8789
977	IUR	0.8785
978	FA6	0.8785
979	KPL	0.8785
980	30G	0.8785
981	4AN	0.8783
982	FA1	0.8783
983	HIO	0.8783
984	MQB	0.8783
985	6R8	0.8782
986	PSV	0.8782
987	ALA PRO	0.8782
988	LT8	0.8781
989	APG	0.8779
990	CGB	0.8778
991	FSW	0.8778
992	APS	0.8776
993	IUP	0.8776
994	717	0.8776
995	JDN	0.8775
996	SS1	0.8775
997	GSY	0.8774
998	3ZQ	0.8770
999	ZBT	0.8769
1000	HQJ	0.8768
1001	9ZE	0.8764
1002	SIF	0.8764
1003	CKA	0.8763
1004	1M2	0.8762
1005	4VY	0.8762
1006	PAF	0.8759
1007	FLC	0.8759
1008	E7R	0.8759
1009	RCO	0.8756
1010	SR4	0.8753
1011	6HQ	0.8749
1012	L99	0.8745
1013	FUD	0.8745
1014	JR2	0.8744
1015	TRC	0.8744
1016	GVG	0.8743
1017	15E	0.8742
1018	CIT	0.8739
1019	TCZ	0.8738
1020	4PW	0.8738
1021	9KH	0.8737
1022	M6Z	0.8734
1023	OHP	0.8734
1024	2F6	0.8733
1025	URA	0.8733
1026	3MH	0.8730
1027	D3M	0.8730
1028	T9G	0.8729
1029	CRS	0.8729
1030	BNT	0.8728
1031	284	0.8727
1032	7MK	0.8726
1033	QM1	0.8723
1034	MLT	0.8722
1035	1U1	0.8721
1036	C2A	0.8721
1037	LG3	0.8721
1038	JFJ	0.8719
1039	EMZ	0.8718
1040	JA8	0.8714
1041	4FH	0.8712
1042	4P5	0.8711
1043	URQ	0.8710
1044	LG5	0.8708
1045	3BU	0.8707
1046	26D	0.8706
1047	SFU	0.8705
1048	AX3	0.8705
1049	7I2	0.8704
1050	4A5	0.8703
1051	JB8	0.8703
1052	PFL	0.8698
1053	42J	0.8698
1054	SLS	0.8697
1055	PBA	0.8697
1056	CH9	0.8696
1057	CYT	0.8695
1058	B56	0.8694
1059	XXP	0.8694
1060	RHU	0.8693
1061	3CH	0.8693
1062	40O	0.8693
1063	ESI	0.8691
1064	AUD	0.8690
1065	L5V	0.8689
1066	URP	0.8689
1067	PHB	0.8688
1068	ZB1	0.8687
1069	DNA	0.8685
1070	67X	0.8682
1071	TM4	0.8680
1072	HBA	0.8680
1073	FAN	0.8679
1074	JF1	0.8679
1075	8XL	0.8678
1076	ARP	0.8677
1077	EGR	0.8676
1078	39U	0.8673
1079	9TY	0.8670
1080	CAQ	0.8670
1081	IT2	0.8668
1082	BVF	0.8667
1083	L7T	0.8665
1084	3TJ	0.8664
1085	7A3	0.8664
1086	0W1	0.8660
1087	8GF	0.8659
1088	OXE	0.8658
1089	28S	0.8657
1090	4SX	0.8656
1091	6X9	0.8655
1092	3J8	0.8655
1093	92Z	0.8647
1094	PAB	0.8645
1095	NAG	0.8642
1096	F2W	0.8642
1097	KGK	0.8641
1098	PEZ	0.8640
1099	PHE	0.8637
1100	CIG	0.8633
1101	H5B	0.8633
1102	L89	0.8633
1103	TXW	0.8631
1104	94N	0.8630
1105	1AN	0.8630
1106	8LG	0.8626
1107	2O6	0.8624
1108	LMR	0.8624
1109	HBD	0.8622
1110	FP2	0.8621
1111	2AF	0.8621
1112	64E	0.8620
1113	PKU	0.8619
1114	1Y6	0.8618
1115	5VL	0.8615
1116	J1Z	0.8614
1117	DYA	0.8612
1118	ASP	0.8611
1119	Q02	0.8610
1120	IBM	0.8606
1121	PBR	0.8604
1122	2D3	0.8602
1123	BEW	0.8601
1124	NBG	0.8601
1125	76X	0.8601
1126	PQK	0.8599
1127	57O	0.8595
1128	PBZ	0.8594
1129	4H2	0.8589
1130	PJW	0.8585
1131	E5X	0.8585
1132	K37	0.8584
1133	TIY	0.8582
1134	AY4	0.8580
1135	M3T	0.8579
1136	2CH	0.8578
1137	HTS	0.8577
1138	AA	0.8575
1139	JZ0	0.8574
1140	5VJ	0.8573
1141	93Q	0.8572
1142	2CL	0.8571
1143	HGQ	0.8567
1144	938	0.8567
1145	HEW	0.8565
1146	B3R	0.8564
1147	TQU	0.8562
1148	XQK	0.8560
1149	WOT	0.8560
1150	KTW	0.8560
1151	1DV	0.8556
1152	Z82	0.8545
1153	TNF	0.8542
1154	2JK	0.8527
1155	YAN	0.8521

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

Pocket No.: 1; Query (leader) PDB : 1RSD; Ligand: PSB; 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: 1rsd.bio1) has 54 residues
No:	Leader PDB	Ligand	Sequence Similarity

Pocket No.: 2; Query (leader) PDB : 1RSD; Ligand: PSB; 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: 1rsd.bio1) has 54 residues
No:	Leader PDB	Ligand	Sequence Similarity

Pocket No.: 3; Query (leader) PDB : 1RSD; Ligand: PSB; 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: 1rsd.bio1) has 54 residues
No:	Leader PDB	Ligand	Sequence Similarity

Pocket No.: 4; Query (leader) PDB : 1RSD; Ligand: PSB; 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: 1rsd.bio1) has 54 residues
No:	Leader PDB	Ligand	Sequence Similarity

Pocket No.: 5; Query (leader) PDB : 1RSD; Ligand: PSB; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.

This union binding pocket(no: 5) in the query (biounit: 1rsd.bio1) has 54 residues
No:	Leader PDB	Ligand	Sequence Similarity

Pocket No.: 6; Query (leader) PDB : 1RSD; Ligand: PSB; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.

This union binding pocket(no: 6) in the query (biounit: 1rsd.bio1) has 54 residues
No:	Leader PDB	Ligand	Sequence Similarity

Pocket No.: 7; Query (leader) PDB : 1RSD; Ligand: PSB; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.

This union binding pocket(no: 7) in the query (biounit: 1rsd.bio1) has 54 residues
No:	Leader PDB	Ligand	Sequence Similarity

Pocket No.: 8; Query (leader) PDB : 1RSD; Ligand: PSB; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.

This union binding pocket(no: 8) in the query (biounit: 1rsd.bio1) has 54 residues
No:	Leader PDB	Ligand	Sequence Similarity

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