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Receptor

PDB id	Resolution	Class	Description	Source	Keywords
3NGC	2.25 Å	EC: 1.5.3.5	COMPLEX OF 6-HYDROXY-L-NICOTINE OXIDASE WITH INTERMEDIATE METHYLMYOSMINE PRODUCT FORMED DURING CATALYTIC TURNOVER	ARTHROBACTER NICOTINOVORANS	ENANTHIOMERIC SUBSTRATE-INHIBITOR FLAVOENZYMES NICOTINE DEGRADATION OXIDOREDUCTASE
Ref.:	CRYSTAL STRUCTURE ANALYSIS OF FREE AND SUBSTRATE-BO 6-HYDROXY-L-NICOTINE OXIDASE FROM ARTHROBACTER NICOTINOVORANS. J.MOL.BIOL. V. 396 785 2010

Ligand

Ligand	Chain:Residue	Validity	Ligand Warnings	Binding Data	Molecular Weight (Da)	Formula	SMILES
FAD	X:434;	Valid;	none;	submit data	785.55	C27 H33 N9 O15 P2	Cc1cc...
GP7	X:435;	Invalid;	none;	submit data	673.901	C36 H68 N O8 P	CCCCC...
HNH	X:436;	Valid;	none;	submit data	176.215	C10 H12 N2 O	CN1CC...
HNL	X:433;	Valid;	none;	submit data	178.231	C10 H14 N2 O	C[N@@...

View in 3D viewer

90% Homology Family

Leader

PDB id	Resolution	Class	Description	Source	Keywords
3K7M	1.95 Å	EC: 1.5.3.5	CRYSTAL STRUCTURE OF 6-HYDROXY-L-NICOTINE OXIDASE FROM ARTHR NICOTINOVORANS	ARTHROBACTER NICOTINOVORANS	ENANTIOMERIC SUBSTRATES FLAVOENZYMES NICOTINE DEGRADATIONOXIDOREDUCTASE
Ref.:	CRYSTAL STRUCTURE ANALYSIS OF FREE AND SUBSTRATE-BO 6-HYDROXY-L-NICOTINE OXIDASE FROM ARTHROBACTER NICOTINOVORANS. J.MOL.BIOL. V. 396 785 2010

Members (7)

No:	PDB id	Binding Data	Representative ligand	Formula	Smiles
The Class containing this family consists of a total of 1 families.
1	3NH3	-	HNL	C10 H14 N2 O	C[N@@]1CCC....
2	3NGC	-	HNH	C10 H12 N2 O	CN1CCC=C1c....
3	3K7M	-	FAD	C27 H33 N9 O15 P2	Cc1cc2c(cc....
4	3NK1	-	SRO	C10 H12 N2 O	c1cc2c(cc1....
5	3K7Q	-	HNL	C10 H14 N2 O	C[N@@]1CCC....
6	3NN6	-	HNK	C10 H14 N2 O	C[N@]1CCC[....
7	3NK0	-	HNK	C10 H14 N2 O	C[N@]1CCC[....

70% Homology Family (7)

No:	PDB id	Binding Data	Representative ligand	Formula	Smiles
The Class containing this family consists of a total of 1 families.
1	3NH3	-	HNL	C10 H14 N2 O	C[N@@]1CCC....
2	3NGC	-	HNH	C10 H12 N2 O	CN1CCC=C1c....
3	3K7M	-	FAD	C27 H33 N9 O15 P2	Cc1cc2c(cc....
4	3NK1	-	SRO	C10 H12 N2 O	c1cc2c(cc1....
5	3K7Q	-	HNL	C10 H14 N2 O	C[N@@]1CCC....
6	3NN6	-	HNK	C10 H14 N2 O	C[N@]1CCC[....
7	3NK0	-	HNK	C10 H14 N2 O	C[N@]1CCC[....

50% Homology Family (7)

No:	PDB id	Binding Data	Representative ligand	Formula	Smiles
The Class containing this family consists of a total of 1 families.
1	3NH3	-	HNL	C10 H14 N2 O	C[N@@]1CCC....
2	3NGC	-	HNH	C10 H12 N2 O	CN1CCC=C1c....
3	3K7M	-	FAD	C27 H33 N9 O15 P2	Cc1cc2c(cc....
4	3NK1	-	SRO	C10 H12 N2 O	c1cc2c(cc1....
5	3K7Q	-	HNL	C10 H14 N2 O	C[N@@]1CCC....
6	3NN6	-	HNK	C10 H14 N2 O	C[N@]1CCC[....
7	3NK0	-	HNK	C10 H14 N2 O	C[N@]1CCC[....

Polypharmacology

Similar Ligands (2D)

Ligand no: 1; Ligand: FAD; Similar ligands found: 147

No:	Ligand	ECFP6 Tc	MDL keys Tc
1	FAS	1	1
2	FAD	1	1
3	FAY	0.859259	0.9875
4	RFL	0.852941	0.963855
5	UBG	0.845588	0.987654
6	6FA	0.794118	0.987654
7	FAE	0.751773	0.987654
8	SFD	0.651007	0.860215
9	FDA	0.641892	0.906977
10	FNK	0.602564	0.876405
11	JNT	0.598425	0.876543
12	FAJ	0.57485	0.97561
13	62F	0.572327	0.939024
14	F2N	0.566265	0.886364
15	FMN	0.543307	0.876543
16	FA9	0.526316	0.939759
17	6YU	0.516304	0.860215
18	CNV FAD	0.511905	0.908046
19	P6G FDA	0.511628	0.908046
20	FAD NBT	0.508876	0.83871
21	A2D	0.504065	0.875
22	DAL FAD PER	0.491429	0.836957
23	P5F	0.491329	0.941176
24	FAD CNX	0.488506	0.8125
25	APR	0.488372	0.851852
26	AR6	0.488372	0.851852
27	FAD T2C	0.485876	0.819149
28	AGS	0.484615	0.811765
29	M33	0.484375	0.864198
30	BA3	0.484127	0.875
31	ATP	0.48062	0.851852
32	HEJ	0.48062	0.851852
33	B4P	0.480315	0.875
34	ADP	0.480315	0.851852
35	AP5	0.480315	0.875
36	ANP	0.477273	0.831325
37	5FA	0.476923	0.851852
38	AQP	0.476923	0.851852
39	48N	0.469388	0.902439
40	OAD	0.467626	0.876543
41	9X8	0.467626	0.833333
42	FAD NBA	0.467033	0.793814
43	GTA	0.465753	0.892857
44	AT4	0.465116	0.821429
45	AN2	0.465116	0.841463
46	HQG	0.463235	0.841463
47	AD9	0.462121	0.831325
48	3OD	0.460993	0.876543
49	RBF	0.460938	0.790123
50	FB0	0.460606	0.835165
51	139	0.460526	0.858824
52	AP0	0.46	0.835294
53	A22	0.459854	0.864198
54	ACP	0.458015	0.853659
55	8QN	0.456522	0.864198
56	PRX	0.454545	0.831325
57	A3R	0.453237	0.86747
58	A1R	0.453237	0.86747
59	G3A	0.452055	0.902439
60	T5A	0.45098	0.872093
61	G5P	0.44898	0.902439
62	ATF	0.448529	0.821429
63	50T	0.44697	0.819277
64	OZV	0.446043	0.851852
65	6YZ	0.445255	0.853659
66	ACQ	0.444444	0.853659
67	ADQ	0.442857	0.853659
68	PAJ	0.442857	0.847059
69	KMQ	0.441379	0.843373
70	8LE	0.441176	0.855422
71	5AL	0.441176	0.864198
72	ADX	0.439394	0.775281
73	CA0	0.439394	0.853659
74	8LQ	0.438849	0.865854
75	QA7	0.438849	0.855422
76	A4P	0.437909	0.831461
77	25L	0.4375	0.864198
78	P33 FDA	0.436464	0.817204
79	KG4	0.43609	0.853659
80	5SV	0.435714	0.793103
81	8LH	0.434783	0.843373
82	OMR	0.434211	0.818182
83	TXE	0.434211	0.890244
84	45A	0.434109	0.829268
85	ABM	0.434109	0.829268
86	AMP	0.433071	0.82716
87	A	0.433071	0.82716
88	4AD	0.432624	0.855422
89	ADJ	0.432258	0.818182
90	B5M	0.431507	0.878049
91	B5Y	0.431507	0.878049
92	BIS	0.430556	0.802326
93	DJC FAD	0.43	0.827957
94	SRA	0.429688	0.788235
95	AFH	0.42953	0.825581
96	DND	0.427632	0.865854
97	TXD	0.427632	0.890244
98	UP5	0.427632	0.878049
99	6V0	0.427632	0.857143
100	DQV	0.426667	0.8875
101	SRP	0.42446	0.843373
102	PR8	0.423611	0.837209
103	TAT	0.423358	0.821429
104	T99	0.423358	0.821429
105	AMO	0.422535	0.865854
106	PTJ	0.42069	0.835294
107	TXA	0.42069	0.865854
108	FYA	0.42069	0.864198
109	CNA	0.420382	0.865854
110	AHX	0.41958	0.835294
111	00A	0.41958	0.823529
112	AMP MG	0.418605	0.814815
113	MAP	0.41844	0.811765
114	NAI	0.418301	0.845238
115	AU1	0.41791	0.831325
116	A12	0.416667	0.843373
117	AP2	0.416667	0.843373
118	9ZD	0.415493	0.845238
119	25A	0.415493	0.851852
120	9ZA	0.415493	0.845238
121	COD	0.415094	0.842697
122	4TC	0.412903	0.879518
123	APC	0.411765	0.843373
124	ME8	0.410959	0.806818
125	1ZZ	0.410959	0.806818
126	NB8	0.410959	0.835294
127	ADP BEF	0.410448	0.82716
128	ADP MG	0.410448	0.82716
129	DJ0 FAD	0.41	0.865169
130	4UW	0.409091	0.825581
131	NAX	0.409091	0.837209
132	F2R	0.408805	0.850575
133	ADV	0.408759	0.843373
134	RBY	0.408759	0.843373
135	VO4 ADP	0.407143	0.809524
136	P1H	0.405882	0.818182
137	BEF ADP	0.405797	0.807229
138	OOB	0.405594	0.864198
139	LAD	0.40411	0.825581
140	UPA	0.403846	0.86747
141	4UU	0.401316	0.833333
142	GA7	0.401316	0.865854
143	A3D	0.401235	0.876543
144	80F	0.401235	0.808989
145	DLL	0.4	0.864198
146	XAH	0.4	0.806818
147	V2G	0.4	0.857143

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

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

Ligand no: 3; Ligand: HNL; Similar ligands found: 3

No:	Ligand	ECFP6 Tc	MDL keys Tc
1	HNK	1	1
2	HNL	1	1
3	NCT	0.530612	0.804348

Similar Ligands (3D)

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

No:	Ligand	Similarity coefficient
1	FDA T2C	0.8610

Ligand no: 2; Ligand: HNH; Similar ligands found: 511

No:	Ligand	Similarity coefficient
1	1Z6	0.9864
2	KTJ	0.9862
3	HNL	0.9842
4	HNK	0.9794
5	BNL	0.9769
6	CPZ	0.9751
7	MSR	0.9745
8	A5E	0.9735
9	JF6	0.9730
10	50C	0.9703
11	SNU	0.9685
12	GVG	0.9674
13	PH3	0.9639
14	TZF	0.9598
15	NCT	0.9586
16	HX4	0.9560
17	SQ4	0.9558
18	C1M	0.9536
19	SV4	0.9534
20	AOT	0.9526
21	F4K	0.9509
22	92G	0.9499
23	JRB	0.9498
24	TT4	0.9485
25	HL4	0.9464
26	L13	0.9462
27	1WC	0.9452
28	7VP	0.9445
29	A9P	0.9440
30	46P	0.9434
31	HHH	0.9434
32	36Y	0.9411
33	4PN	0.9409
34	XDK	0.9406
35	K80	0.9405
36	0NX	0.9404
37	PIY	0.9394
38	PIM	0.9394
39	TYE	0.9385
40	1XA	0.9371
41	80G	0.9371
42	TYR	0.9362
43	CH9	0.9361
44	0BP	0.9359
45	BPY	0.9336
46	JAH	0.9329
47	W29	0.9314
48	PHE	0.9312
49	TYL	0.9308
50	X48	0.9303
51	4BF	0.9302
52	BP3	0.9300
53	1A5	0.9297
54	HF2	0.9295
55	4LV	0.9291
56	BRH	0.9291
57	DPN	0.9287
58	B2Y	0.9287
59	FMQ	0.9285
60	PJW	0.9279
61	OTR	0.9279
62	EN1	0.9277
63	N2Z	0.9271
64	CK2	0.9270
65	MPK	0.9269
66	BP7	0.9268
67	DC5	0.9268
68	A4N	0.9261
69	SHI	0.9260
70	4LW	0.9259
71	173	0.9257
72	DTY	0.9254
73	TIH	0.9250
74	FHC	0.9244
75	HDH	0.9243
76	RA7	0.9237
77	1A7	0.9234
78	52C	0.9232
79	2F6	0.9227
80	F4E	0.9227
81	TYC	0.9222
82	J9N	0.9216
83	5VL	0.9215
84	2QC	0.9214
85	NFA	0.9211
86	J9Q	0.9209
87	6SD	0.9206
88	HJH	0.9200
89	HFA	0.9200
90	BCK	0.9198
91	A9O	0.9197
92	R2P	0.9194
93	B3U	0.9192
94	61M	0.9186
95	A4T	0.9184
96	8OZ	0.9177
97	A9K	0.9173
98	54E	0.9173
99	A7K	0.9173
100	FZM	0.9172
101	ENO	0.9163
102	HIC	0.9154
103	KDG	0.9153
104	HIS	0.9152
105	K7M	0.9150
106	PFF	0.9145
107	PPY	0.9145
108	2B4	0.9141
109	DHI	0.9140
110	HHI	0.9140
111	F69	0.9140
112	GT4	0.9138
113	R20	0.9137
114	ODO	0.9136
115	AEG	0.9136
116	MPV	0.9135
117	492	0.9126
118	N3W	0.9126
119	9FH	0.9123
120	C53	0.9120
121	6HO	0.9120
122	SWX	0.9117
123	GZQ	0.9113
124	1KN	0.9108
125	56D	0.9105
126	CK1	0.9103
127	S2P	0.9102
128	RUY	0.9101
129	QUS	0.9101
130	T2D	0.9100
131	OQC	0.9100
132	E3X	0.9099
133	ICB	0.9097
134	LFC	0.9095
135	L5V	0.9092
136	1L5	0.9081
137	LNR	0.9080
138	KYN	0.9075
139	C82	0.9072
140	6FZ	0.9067
141	PQS	0.9062
142	L15	0.9060
143	49O	0.9057
144	I3E	0.9054
145	M3H	0.9049
146	4HP	0.9048
147	ODK	0.9047
148	XCG	0.9046
149	SQP	0.9044
150	6HX	0.9042
151	MMS	0.9040
152	A29	0.9040
153	TZM	0.9038
154	YZM	0.9036
155	HWD	0.9035
156	BZE	0.9034
157	6ZX	0.9030
158	SQ7	0.9030
159	OGA	0.9030
160	GWM	0.9029
161	92K	0.9029
162	ISZ	0.9024
163	2UB	0.9020
164	XRS	0.9018
165	3C4	0.9017
166	EQW	0.9012
167	DCZ	0.9010
168	8D6	0.9007
169	GZ2	0.9007
170	1BN	0.9005
171	A4Q	0.9004
172	HC4	0.9004
173	B40	0.9000
174	DUR	0.8999
175	AMQ	0.8998
176	PO6	0.8997
177	SOR	0.8996
178	Q06	0.8996
179	DAH	0.8994
180	6J9	0.8993
181	SOJ	0.8993
182	N9J	0.8988
183	23J	0.8983
184	2BX	0.8980
185	OOG	0.8980
186	LLH	0.8976
187	363	0.8976
188	LJ3	0.8975
189	MOK	0.8974
190	7Q1	0.8972
191	L99	0.8968
192	TJM	0.8966
193	C0H	0.8964
194	6P3	0.8963
195	M6H	0.8961
196	K34	0.8959
197	4V2	0.8958
198	ZZA	0.8955
199	9UL	0.8954
200	6J5	0.8950
201	N8Z	0.8950
202	AWE	0.8948
203	7O4	0.8947
204	HQJ	0.8946
205	3VW	0.8946
206	6TZ	0.8944
207	9FG	0.8942
208	97T	0.8939
209	SNV	0.8939
210	7QS	0.8938
211	FCD	0.8935
212	AHN	0.8935
213	HXY	0.8934
214	5NI	0.8930
215	FTV	0.8929
216	36E	0.8927
217	F16	0.8926
218	7UZ	0.8926
219	B4O	0.8925
220	BP6	0.8924
221	GRO	0.8920
222	26C	0.8920
223	IWT	0.8918
224	GLN	0.8916
225	1FD	0.8913
226	SYM	0.8912
227	IPO	0.8911
228	YOF	0.8911
229	G14	0.8910
230	DIR	0.8907
231	9RW	0.8907
232	2FY	0.8907
233	M5E	0.8904
234	E0O	0.8902
235	I1E	0.8901
236	TOH	0.8897
237	CS2	0.8894
238	VC3	0.8893
239	MTL	0.8892
240	AMS	0.8891
241	DHY	0.8891
242	PHI	0.8891
243	SMN	0.8889
244	GVY	0.8889
245	DAL DAL	0.8887
246	9W5	0.8886
247	FWD	0.8886
248	KF5	0.8885
249	AMH	0.8884
250	0A9	0.8884
251	TMG	0.8882
252	ERZ	0.8879
253	1F1	0.8879
254	TB8	0.8878
255	1VK	0.8876
256	BZ2	0.8873
257	B1J	0.8869
258	Z70	0.8868
259	CTN	0.8868
260	AKG	0.8867
261	M3E	0.8865
262	4VY	0.8863
263	URI	0.8863
264	CWD	0.8861
265	WOE	0.8861
266	SAF	0.8861
267	152	0.8856
268	JZA	0.8854
269	DDU	0.8854
270	J27	0.8854
271	A4B	0.8852
272	IWD	0.8851
273	KLE	0.8850
274	HPP	0.8850
275	977	0.8850
276	BPS	0.8846
277	AVI	0.8844
278	6NI	0.8843
279	AU8	0.8843
280	URD	0.8843
281	DGN	0.8842
282	TCA	0.8841
283	GNW	0.8840
284	CLU	0.8840
285	CP6	0.8840
286	R9J	0.8840
287	GLU	0.8840
288	UN1	0.8838
289	PHU	0.8837
290	5LA	0.8837
291	PAC	0.8836
292	ESX	0.8835
293	URO	0.8834
294	S0G	0.8834
295	3VS	0.8834
296	CTD	0.8832
297	FBM	0.8831
298	5AE	0.8829
299	QBS	0.8826
300	3QM	0.8825
301	IYR	0.8825
302	88L	0.8823
303	GJZ	0.8822
304	FPL	0.8822
305	BWD	0.8822
306	5O6	0.8822
307	HX8	0.8820
308	TSU	0.8819
309	CH8	0.8815
310	LVD	0.8812
311	ALA ALA	0.8812
312	BHO	0.8812
313	PTU	0.8809
314	P81	0.8807
315	BBY	0.8805
316	16Z	0.8805
317	7R4	0.8802
318	QY9	0.8802
319	DE5	0.8800
320	JPQ	0.8799
321	THU	0.8797
322	3QO	0.8796
323	NIZ	0.8793
324	F9P	0.8793
325	CC5	0.8792
326	ALE	0.8791
327	XIZ	0.8791
328	7ZL	0.8790
329	AAN	0.8790
330	ESP	0.8789
331	4NB	0.8789
332	ISA	0.8788
333	HCI	0.8788
334	MJ5	0.8788
335	AVJ	0.8787
336	TRP	0.8787
337	S2G	0.8786
338	8U3	0.8784
339	SOV	0.8784
340	AX3	0.8777
341	4FP	0.8775
342	DHC	0.8773
343	9ZE	0.8772
344	4I8	0.8772
345	HBD	0.8771
346	LOT	0.8771
347	PIR	0.8770
348	61O	0.8770
349	2JM	0.8769
350	4BY	0.8768
351	HPS	0.8768
352	KMY	0.8768
353	OBP	0.8765
354	6KT	0.8764
355	UA5	0.8762
356	ONR	0.8761
357	PQM	0.8761
358	QMP	0.8760
359	0QW	0.8759
360	L22	0.8759
361	SAN	0.8759
362	A3M	0.8755
363	791	0.8754
364	C2M	0.8754
365	1CY	0.8752
366	1FF	0.8751
367	TGX	0.8750
368	CP7	0.8750
369	5H6	0.8748
370	DE3	0.8748
371	ANN	0.8748
372	5TT	0.8745
373	I4B	0.8745
374	4CF	0.8744
375	S0E	0.8743
376	2AL	0.8742
377	L14	0.8742
378	1Z8	0.8742
379	1X4	0.8739
380	4J8	0.8739
381	DNB	0.8738
382	Y4L	0.8737
383	YRL	0.8736
384	DTR	0.8735
385	S0D	0.8734
386	P7Y	0.8734
387	J6W	0.8734
388	AP4	0.8734
389	2HG	0.8734
390	KBZ	0.8733
391	BVA	0.8733
392	M4S	0.8732
393	NAG	0.8732
394	89J	0.8731
395	HSO	0.8729
396	3ZB	0.8729
397	HBO	0.8728
398	E4P	0.8728
399	ZEB	0.8727
400	B2T	0.8727
401	FBS	0.8724
402	ID2	0.8722
403	0JD	0.8721
404	GCO	0.8720
405	Q04	0.8720
406	CXH	0.8720
407	4XF	0.8719
408	XRX	0.8718
409	B85	0.8718
410	QME	0.8718
411	EVF	0.8716
412	8NX	0.8716
413	9RH	0.8712
414	FCR	0.8708
415	APG	0.8707
416	GLO	0.8705
417	X0U	0.8705
418	EXD	0.8704
419	BNF	0.8701
420	I5A	0.8699
421	3YP	0.8698
422	PHB	0.8696
423	THM	0.8696
424	P80	0.8696
425	3VX	0.8695
426	15N	0.8695
427	4NP	0.8693
428	CFA	0.8692
429	OA1	0.8692
430	2FT	0.8691
431	X0V	0.8690
432	4FA	0.8689
433	RKN	0.8689
434	SN4	0.8688
435	N1E	0.8688
436	2TU	0.8687
437	N2Y	0.8686
438	SNO	0.8685
439	TYU	0.8685
440	EGR	0.8685
441	IAC	0.8684
442	EAT	0.8672
443	AUT	0.8671
444	DHZ	0.8670
445	4Z3	0.8668
446	URS	0.8666
447	2LT	0.8664
448	AAS	0.8663
449	428	0.8662
450	MAJ	0.8661
451	28A	0.8660
452	78U	0.8659
453	5BT	0.8654
454	7MU	0.8653
455	FF3	0.8652
456	9H2	0.8649
457	6XI	0.8646
458	4NC	0.8643
459	RKV	0.8640
460	F06	0.8640
461	42R	0.8637
462	BY5	0.8637
463	GFE	0.8637
464	4FH	0.8634
465	9PL	0.8631
466	8UY	0.8631
467	1PS	0.8631
468	54Z	0.8629
469	SYC	0.8627
470	41K	0.8626
471	9R5	0.8625
472	HJ8	0.8625
473	AMR	0.8625
474	A8Q	0.8623
475	5AD	0.8621
476	LYS	0.8620
477	MIL	0.8620
478	069	0.8617
479	4NS	0.8616
480	DGL	0.8612
481	92P	0.8611
482	72E	0.8610
483	KLS	0.8609
484	ASC	0.8604
485	4JC	0.8600
486	8WO	0.8600
487	GEO	0.8600
488	A6H	0.8599
489	3AE	0.8597
490	U2Z	0.8593
491	Q03	0.8590
492	A7N	0.8588
493	L1T	0.8586
494	BTM	0.8583
495	EOU	0.8583
496	4SX	0.8583
497	PRA	0.8583
498	4MP	0.8583
499	IFP	0.8574
500	TZL	0.8572
501	AEF	0.8571
502	5UD	0.8570
503	4NZ	0.8566
504	MAH	0.8565
505	ADN	0.8561
506	449	0.8560
507	AVA	0.8552
508	PMF	0.8551
509	PBQ	0.8548
510	SD4	0.8536
511	CCU	0.8529

Ligand no: 3; Ligand: HNL; Similar ligands found: 671

No:	Ligand	Similarity coefficient
1	HNH	0.9842
2	KTJ	0.9789
3	1Z6	0.9763
4	L13	0.9642
5	MSR	0.9617
6	GVG	0.9615
7	JF6	0.9614
8	50C	0.9587
9	CPZ	0.9565
10	HHH	0.9563
11	A5E	0.9555
12	JRB	0.9543
13	4PN	0.9542
14	BNL	0.9538
15	ENO	0.9514
16	SNU	0.9496
17	AOT	0.9483
18	CH9	0.9478
19	M3H	0.9477
20	HNM	0.9475
21	DTY	0.9455
22	1XA	0.9447
23	TT4	0.9447
24	36Y	0.9446
25	A9P	0.9444
26	1A7	0.9443
27	7VP	0.9435
28	PH3	0.9432
29	PFF	0.9431
30	HX4	0.9430
31	PIM	0.9420
32	TYR	0.9420
33	SQ4	0.9411
34	K80	0.9410
35	SHI	0.9401
36	PIY	0.9398
37	XDK	0.9397
38	J9N	0.9386
39	TZF	0.9386
40	PHE	0.9381
41	92G	0.9373
42	DPN	0.9371
43	MPK	0.9369
44	B3U	0.9368
45	SV4	0.9356
46	NFA	0.9353
47	0NX	0.9351
48	BRH	0.9348
49	TYC	0.9347
50	EN1	0.9346
51	PJW	0.9345
52	HF2	0.9345
53	QUS	0.9344
54	HIS	0.9339
55	FTV	0.9327
56	OTR	0.9327
57	FHC	0.9320
58	TYL	0.9318
59	HIC	0.9313
60	F4K	0.9313
61	46P	0.9307
62	S2P	0.9306
63	PPY	0.9297
64	J9Q	0.9295
65	N2Z	0.9289
66	1WC	0.9288
67	4LW	0.9287
68	W29	0.9287
69	HL4	0.9285
70	3QM	0.9284
71	TIH	0.9280
72	CK2	0.9278
73	173	0.9270
74	BPY	0.9270
75	B40	0.9267
76	TYE	0.9266
77	2F6	0.9264
78	RA7	0.9263
79	RUY	0.9262
80	492	0.9261
81	JAH	0.9261
82	B2Y	0.9260
83	M6H	0.9255
84	M5E	0.9254
85	4HP	0.9254
86	A7K	0.9254
87	HWD	0.9249
88	HFA	0.9248
89	C1M	0.9244
90	SQ7	0.9240
91	56D	0.9237
92	C53	0.9234
93	0BP	0.9230
94	4LV	0.9227
95	KDG	0.9223
96	X48	0.9222
97	GVY	0.9221
98	9W5	0.9220
99	80G	0.9220
100	QBS	0.9218
101	HDH	0.9217
102	4BF	0.9216
103	HJH	0.9216
104	R2P	0.9213
105	MPV	0.9212
106	R20	0.9212
107	A29	0.9209
108	HHI	0.9208
109	2UB	0.9205
110	LNR	0.9205
111	SMN	0.9202
112	1L5	0.9200
113	SWX	0.9190
114	GWM	0.9183
115	1KN	0.9181
116	AMQ	0.9180
117	6SD	0.9171
118	PHI	0.9170
119	1VK	0.9170
120	GT4	0.9169
121	SOR	0.9169
122	X11	0.9167
123	5VL	0.9164
124	3LR	0.9163
125	HQJ	0.9162
126	CK1	0.9159
127	BP3	0.9157
128	K7M	0.9156
129	EQW	0.9155
130	TZM	0.9155
131	AEG	0.9154
132	9FH	0.9154
133	3CR	0.9152
134	23J	0.9151
135	FMQ	0.9150
136	E0O	0.9150
137	6HX	0.9148
138	DAH	0.9147
139	N2Y	0.9145
140	9RW	0.9142
141	BCK	0.9141
142	DEW	0.9135
143	6HO	0.9135
144	F4E	0.9134
145	1BN	0.9133
146	BZE	0.9131
147	363	0.9130
148	LLH	0.9130
149	T2D	0.9127
150	X0U	0.9126
151	N3W	0.9125
152	2QC	0.9124
153	92K	0.9123
154	MMS	0.9122
155	M45	0.9119
156	DHI	0.9113
157	GZ2	0.9112
158	DDU	0.9111
159	97T	0.9110
160	ESP	0.9108
161	BZ2	0.9107
162	A4N	0.9102
163	HC4	0.9101
164	3VW	0.9097
165	TGX	0.9097
166	YZM	0.9093
167	1F1	0.9092
168	0A9	0.9091
169	3QO	0.9090
170	L5V	0.9088
171	P58	0.9086
172	DC5	0.9086
173	ODK	0.9085
174	61M	0.9081
175	K34	0.9080
176	GZQ	0.9079
177	A9O	0.9078
178	C0H	0.9077
179	3C4	0.9075
180	G14	0.9075
181	RMN	0.9075
182	BP7	0.9073
183	6FZ	0.9072
184	7O4	0.9071
185	E3X	0.9070
186	ODO	0.9068
187	FCD	0.9067
188	PO6	0.9064
189	8D6	0.9061
190	L99	0.9059
191	PCS	0.9059
192	SAF	0.9059
193	GRO	0.9057
194	DHC	0.9057
195	MXD	0.9055
196	4ZD	0.9053
197	2B4	0.9053
198	F16	0.9053
199	9R5	0.9052
200	YIE	0.9048
201	TB8	0.9048
202	54E	0.9047
203	D3G	0.9046
204	2BX	0.9046
205	4P5	0.9046
206	BP6	0.9045
207	DIR	0.9044
208	AVI	0.9044
209	SAN	0.9043
210	CFI	0.9042
211	6KT	0.9042
212	A6H	0.9042
213	9UL	0.9041
214	TSU	0.9041
215	52C	0.9040
216	HXY	0.9037
217	PHU	0.9033
218	ZZA	0.9033
219	5WZ	0.9031
220	4V2	0.9031
221	XCG	0.9027
222	IWD	0.9026
223	THU	0.9025
224	A4T	0.9024
225	HCI	0.9022
226	152	0.9022
227	5AE	0.9021
228	ERZ	0.9021
229	FWD	0.9021
230	ANN	0.9021
231	F69	0.9018
232	7Q1	0.9018
233	7QS	0.9018
234	0QW	0.9016
235	CWD	0.9016
236	JGB	0.9015
237	36M	0.9015
238	8OZ	0.9015
239	SYM	0.9014
240	KYN	0.9011
241	APG	0.9009
242	J6W	0.9006
243	TOH	0.9005
244	OGA	0.9005
245	6TZ	0.9005
246	AKG	0.9004
247	DHY	0.9001
248	L15	0.9000
249	A9K	0.8998
250	428	0.8996
251	9FG	0.8995
252	UN1	0.8994
253	OOG	0.8990
254	FZM	0.8989
255	P81	0.8988
256	ARG	0.8984
257	HBO	0.8983
258	C82	0.8983
259	0F9	0.8982
260	791	0.8981
261	2HG	0.8981
262	3VQ	0.8978
263	SNV	0.8977
264	YOF	0.8977
265	CXP	0.8976
266	URI	0.8975
267	I3E	0.8974
268	I5A	0.8971
269	JDN	0.8971
270	MOK	0.8970
271	5NI	0.8970
272	BWD	0.8969
273	IYR	0.8967
274	OQC	0.8966
275	FK8	0.8966
276	HX8	0.8966
277	DUR	0.8964
278	B21	0.8963
279	EXD	0.8961
280	F9P	0.8960
281	2PV	0.8959
282	0JD	0.8959
283	BHO	0.8959
284	AMS	0.8958
285	PF1	0.8957
286	DCZ	0.8956
287	DE3	0.8955
288	ICB	0.8955
289	0A1	0.8954
290	MES	0.8954
291	6J9	0.8952
292	1FD	0.8952
293	CLU	0.8951
294	BQ2	0.8950
295	P7Y	0.8949
296	A3M	0.8949
297	BZQ	0.8948
298	Z70	0.8947
299	KTA	0.8946
300	2HC	0.8946
301	49O	0.8945
302	6J5	0.8945
303	SQP	0.8944
304	4J8	0.8944
305	DAL DAL	0.8942
306	CFA	0.8941
307	7UZ	0.8941
308	2PK	0.8941
309	AAN	0.8939
310	GNW	0.8939
311	TCA	0.8939
312	PHB	0.8939
313	QY9	0.8938
314	33S	0.8936
315	6NI	0.8935
316	ISZ	0.8934
317	TZP	0.8933
318	PAC	0.8933
319	CTN	0.8932
320	FCR	0.8930
321	Q06	0.8929
322	NIZ	0.8928
323	B1J	0.8928
324	AC6	0.8927
325	CS2	0.8927
326	FPL	0.8927
327	MTL	0.8926
328	JB8	0.8925
329	TMG	0.8923
330	HGA	0.8923
331	PIR	0.8923
332	XRS	0.8922
333	ISA	0.8921
334	B41	0.8921
335	DI6	0.8920
336	36E	0.8920
337	I2E	0.8919
338	N9J	0.8918
339	6ZX	0.8918
340	HBD	0.8917
341	2FY	0.8917
342	4VY	0.8917
343	7ZL	0.8916
344	7OD	0.8915
345	3VX	0.8915
346	URO	0.8914
347	AMH	0.8913
348	XIZ	0.8912
349	4I8	0.8912
350	2TU	0.8910
351	HA5	0.8907
352	M3E	0.8906
353	LDC	0.8905
354	M4S	0.8905
355	S0E	0.8905
356	54F	0.8904
357	LGT	0.8903
358	YF3	0.8903
359	GLU	0.8901
360	NPO	0.8897
361	PBZ	0.8897
362	FEH	0.8897
363	AHN	0.8897
364	H4E	0.8895
365	4FP	0.8895
366	MJ5	0.8892
367	86L	0.8890
368	I1E	0.8887
369	HPP	0.8886
370	EVF	0.8886
371	Z5P	0.8885
372	GCO	0.8885
373	UA5	0.8885
374	0OL	0.8884
375	15N	0.8881
376	PQS	0.8880
377	2FT	0.8880
378	4HB	0.8880
379	FUD	0.8877
380	M1Z	0.8876
381	GLO	0.8874
382	FBM	0.8874
383	L14	0.8874
384	BTM	0.8874
385	S7A	0.8873
386	ALE	0.8871
387	XDE	0.8871
388	HSO	0.8871
389	VC3	0.8870
390	B4O	0.8864
391	CCU	0.8864
392	GLN	0.8861
393	A4Q	0.8861
394	LL1	0.8859
395	BPS	0.8858
396	EYV	0.8857
397	Y4L	0.8856
398	AAS	0.8855
399	4SX	0.8855
400	KLE	0.8854
401	B09	0.8853
402	LJ3	0.8853
403	4JC	0.8853
404	1M2	0.8852
405	CH8	0.8852
406	IC9	0.8851
407	EGR	0.8850
408	DHB	0.8848
409	88L	0.8848
410	069	0.8848
411	AHC	0.8848
412	8WO	0.8847
413	SW7	0.8847
414	4XF	0.8847
415	HPS	0.8847
416	PPT	0.8847
417	8U3	0.8847
418	PUE	0.8843
419	WOE	0.8842
420	SHA	0.8842
421	268	0.8839
422	URD	0.8839
423	IAC	0.8838
424	CXH	0.8838
425	MAJ	0.8838
426	LL2	0.8838
427	8NX	0.8837
428	FBS	0.8836
429	VXX	0.8835
430	RQD	0.8835
431	2C2	0.8835
432	ZEB	0.8835
433	9B3	0.8835
434	KF5	0.8835
435	977	0.8833
436	PTU	0.8833
437	7R4	0.8831
438	9ZE	0.8830
439	DHZ	0.8830
440	EAT	0.8830
441	MP5	0.8829
442	MS9	0.8829
443	CTD	0.8827
444	DTR	0.8827
445	S0G	0.8826
446	2O6	0.8825
447	BNF	0.8824
448	RKV	0.8820
449	EKZ	0.8819
450	SOL	0.8816
451	TYU	0.8816
452	41K	0.8815
453	FF3	0.8815
454	JMG	0.8815
455	CC5	0.8814
456	DZA	0.8814
457	SD4	0.8813
458	S0W	0.8813
459	OA1	0.8812
460	4NS	0.8811
461	P80	0.8810
462	5QY	0.8809
463	16Z	0.8809
464	K4V	0.8809
465	3YP	0.8808
466	7MX	0.8808
467	S2G	0.8808
468	OHP	0.8808
469	2JM	0.8806
470	ATX	0.8805
471	TPA	0.8805
472	GAE	0.8804
473	NFM	0.8803
474	GJP	0.8802
475	Q03	0.8802
476	4CF	0.8801
477	X0V	0.8799
478	Q02	0.8798
479	AP4	0.8798
480	B85	0.8796
481	4NC	0.8796
482	R9J	0.8793
483	THM	0.8793
484	1CY	0.8791
485	JZA	0.8789
486	2IT	0.8789
487	GGL	0.8789
488	GJZ	0.8788
489	ONR	0.8786
490	TRP	0.8786
491	EYJ	0.8786
492	6P3	0.8785
493	AU8	0.8783
494	5AD	0.8782
495	S24	0.8782
496	YRL	0.8781
497	FF2	0.8780
498	IOS	0.8780
499	YPN	0.8780
500	Q04	0.8780
501	QMP	0.8778
502	1Z8	0.8776
503	4FA	0.8775
504	4NP	0.8774
505	26C	0.8774
506	11X	0.8773
507	LVD	0.8772
508	IFP	0.8771
509	SYC	0.8769
510	94W	0.8768
511	9RH	0.8767
512	J9T	0.8766
513	RAT	0.8765
514	BVA	0.8765
515	RNO	0.8764
516	O45	0.8764
517	PRA	0.8764
518	2LT	0.8762
519	PBA	0.8761
520	IOP	0.8759
521	B2T	0.8759
522	TLM	0.8759
523	N1E	0.8758
524	LTT	0.8757
525	TOM	0.8757
526	MXN	0.8756
527	DGN	0.8755
528	258	0.8753
529	PMF	0.8753
530	HJ8	0.8752
531	795	0.8751
532	9PL	0.8748
533	SEP	0.8746
534	AWE	0.8746
535	MCY	0.8745
536	1X4	0.8744
537	BSA	0.8743
538	2BG	0.8739
539	TSR	0.8738
540	ID2	0.8737
541	AMR	0.8736
542	3B4	0.8735
543	DGL	0.8735
544	URS	0.8734
545	A5Q	0.8733
546	2D2	0.8733
547	89J	0.8730
548	9SE	0.8729
549	SNO	0.8728
550	3TC	0.8725
551	92P	0.8724
552	A09	0.8718
553	3PG	0.8717
554	1OS	0.8717
555	4FH	0.8716
556	AEF	0.8716
557	GEO	0.8715
558	SDF	0.8714
559	54Z	0.8713
560	B86	0.8713
561	4NB	0.8712
562	CP6	0.8709
563	QME	0.8709
564	BRD	0.8704
565	MNN	0.8702
566	ASC	0.8699
567	EOU	0.8697
568	KMY	0.8696
569	9BF	0.8696
570	5OO	0.8695
571	AX3	0.8694
572	5TT	0.8694
573	TAG	0.8694
574	5O6	0.8693
575	H4B	0.8693
576	E4P	0.8691
577	F06	0.8690
578	S7J	0.8688
579	NAG	0.8688
580	SBK	0.8687
581	EUE	0.8686
582	4MP	0.8685
583	7MU	0.8683
584	F01	0.8683
585	FA0	0.8683
586	DNB	0.8682
587	78U	0.8681
588	TR4	0.8680
589	MNP	0.8678
590	XIF XYP	0.8677
591	TIA	0.8674
592	FBF	0.8671
593	0OO	0.8670
594	263	0.8667
595	RKN	0.8667
596	C2Y	0.8666
597	3H2	0.8664
598	GLY GLY	0.8664
599	YTX	0.8661
600	22L	0.8660
601	6XI	0.8660
602	RBJ	0.8657
603	TJM	0.8656
604	5UD	0.8655
605	A7Q	0.8653
606	2LY	0.8652
607	NYL	0.8652
608	3AE	0.8651
609	P9E	0.8650
610	BY5	0.8647
611	TI7	0.8645
612	14N	0.8641
613	GZL	0.8641
614	HSX	0.8640
615	LYS	0.8640
616	AR3	0.8640
617	AM1	0.8639
618	49F	0.8639
619	LSQ	0.8638
620	BHA	0.8637
621	28A	0.8636
622	A7N	0.8636
623	AUV	0.8631
624	DER	0.8630
625	LOT	0.8630
626	657	0.8629
627	3Y7	0.8629
628	DOB	0.8629
629	1PS	0.8622
630	PQM	0.8620
631	BCU	0.8615
632	FOM	0.8614
633	K3Y	0.8612
634	KBZ	0.8612
635	8OB	0.8611
636	WVV	0.8609
637	LDP	0.8607
638	2J5	0.8606
639	0OY	0.8606
640	LR5	0.8604
641	OMD	0.8604
642	ZIQ	0.8603
643	ZEC	0.8601
644	LLT	0.8600
645	SN4	0.8600
646	S0D	0.8598
647	2AL	0.8596
648	8OE	0.8596
649	HG3	0.8593
650	FB4	0.8582
651	A8Q	0.8581
652	KLS	0.8581
653	SY4	0.8581
654	BGP	0.8579
655	4MB	0.8578
656	ABF	0.8575
657	5XB	0.8575
658	5CU	0.8572
659	XI7	0.8571
660	TCL	0.8568
661	T9G	0.8562
662	VM1	0.8560
663	J27	0.8550
664	449	0.8550
665	0GA	0.8547
666	4NZ	0.8545
667	EAJ	0.8543
668	6WR	0.8531
669	NGA	0.8530
670	42J	0.8526
671	AVA	0.8522

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

Pocket No.: 1; Query (leader) PDB : 3K7M; Ligand: FAD; Similar sites found with APoc: 43

This union binding pocket(no: 1) in the query (biounit: 3k7m.bio1) has 53 residues
No:	Leader PDB	Ligand	Sequence Similarity
1	1V59	NAD	4.64037
2	3ICT	ADP	4.64037
3	3ICS	ADP	4.64037
4	2JB2	FAD	6.03248
5	2JB2	FAD	6.03248
6	2JB2	PHE	6.03248
7	2JB2	PHE	6.03248
8	6KGQ	DJC FAD	6.11765
9	5ZBC	FAD	7.19258
10	5ZBC	FAD	7.19258
11	4ZCC	FAD	7.44048
12	5G3U	FDA	7.56501
13	5G3U	FDA	7.56501
14	1RSG	FAD	7.65661
15	1YY5	FAD	7.65661
16	1RSG	FAD	7.65661
17	1YY5	FAD	7.65661
18	7C3H	FAD	7.88863
19	6F7L	FAD	9.72851
20	3QJ4	FAD	10.8187
21	3QJ4	FAD	10.8187
22	4FWE	FAD	29.4664
23	4HSU	FAD	29.4664
24	4GUS	FAD	29.4664
25	1REO	FAD	39.2111
26	1H82	GZZ	39.9072
27	1H82	FAD	39.9072
28	1H82	FAD	39.9072
29	5TS5	FAD	40.6032
30	5TS5	FAD	40.6032
31	5TS5	FAD	40.6032
32	5TS5	FAD	40.6032
33	7C4A	FAD	42.6605
34	7C4A	FAD	42.6605
35	2YG3	FAD	43.1555
36	2YG3	FAD	43.1555
37	2VVL	FAD	44.0835
38	2VVL	FAD	44.0835
39	2VVL	FAD	44.0835
40	2VVL	FAD	44.0835
41	2VVL	FAD	44.0835
42	2VVL	FAD	44.0835
43	6LQL	FAD	46.5882

Pocket No.: 2; Query (leader) PDB : 3K7M; Ligand: FAD; 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: 3k7m.bio1) has 53 residues
No:	Leader PDB	Ligand	Sequence Similarity

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