Showing PDB: 3PNA

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Receptor

PDB id	Resolution	Class	Description	Source	Keywords
3PNA	1.5 Å	EC: 2.7.1.37	CRYSTAL STRUCTURE OF CAMP BOUND (91-244)RIA SUBUNIT OF CAMP- PROTEIN KINASE	BOS TAURUS	BETA-BARREL CAMP-BINDING CATALYTIC SUBUNIT TRANSFERASE
Ref.:	CYCLIC AMP ANALOG BLOCKS KINASE ACTIVATION BY STABI INACTIVE CONFORMATION: CONFORMATIONAL SELECTION HIG NEW CONCEPT IN ALLOSTERIC INHIBITOR DESIGN. MOL CELL PROTEOMICS V. 10 M110. 2011

Ligand

Ligand	Chain:Residue	Validity	Ligand Warnings	Binding Data	NGL Viewer	Molecular Weight (Da)	Formula	SMILES
CMP	A:250; B:250;	Valid; Valid;	none; none;	submit data		329.206	C10 H12 N5 O6 P	c1nc(...
GOL	B:251;	Invalid;	none;	submit data		92.094	C3 H8 O3	C(C(C...

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90% Homology Family

Leader

PDB id	Resolution	Class	Description	Source	Keywords
3PNA	1.5 Å	EC: 2.7.1.37	CRYSTAL STRUCTURE OF CAMP BOUND (91-244)RIA SUBUNIT OF CAMP- PROTEIN KINASE	BOS TAURUS	BETA-BARREL CAMP-BINDING CATALYTIC SUBUNIT TRANSFERASE
Ref.:	CYCLIC AMP ANALOG BLOCKS KINASE ACTIVATION BY STABI INACTIVE CONFORMATION: CONFORMATIONAL SELECTION HIG NEW CONCEPT IN ALLOSTERIC INHIBITOR DESIGN. MOL CELL PROTEOMICS V. 10 M110. 2011

Members (1)

No:	PDB id	Binding Data	Representative ligand	Formula	Smiles
The Class containing this family consists of a total of 16 families.
1	3PNA	-	CMP	C10 H12 N5 O6 P	c1nc(c2c(n....

70% Homology Family (1)

No:	PDB id	Binding Data	Representative ligand	Formula	Smiles
The Class containing this family consists of a total of 15 families.
1	3PNA	-	CMP	C10 H12 N5 O6 P	c1nc(c2c(n....

50% Homology Family (9)

No:	PDB id	Binding Data	Representative ligand	Formula	Smiles
The Class containing this family consists of a total of 12 families.
1	5J48	-	6FW	C16 H15 Cl N5 O7 P S	c1cc(ccc1S....
2	3PNA	-	CMP	C10 H12 N5 O6 P	c1nc(c2c(n....
3	5KJY	-	CMP	C10 H12 N5 O6 P	c1nc(c2c(n....
4	5T3N	Kd = 9.1 nM	75G	C10 H11 Cl N5 O5 P S	c1nc2c(nc(....
5	5JIX	-	6J7	C10 H11 Br N5 O7 P	C1[C@@H]2[....
6	1NE6	-	SP1	C10 H12 N5 O5 P S	c1nc(c2c(n....
7	1NE4	-	RP1	C10 H12 N5 O5 P S	c1nc(c2c(n....
8	5KBF	Kd = 1.2 nM	CMP	C10 H12 N5 O6 P	c1nc(c2c(n....
9	1CX4	-	CMP	C10 H12 N5 O6 P	c1nc(c2c(n....

Polypharmacology

Similar Ligands

Ligand no: 1; Ligand: CMP; Similar ligands found: 94

No:	Ligand	ECFP6 Tc	MDL keys Tc
1	CMP	1	1
2	2BA	1	0.984848
3	SP1	0.757143	0.928571
4	RP1	0.757143	0.928571
5	1YD	0.727273	0.902778
6	4BW	0.727273	0.902778
7	1SY	0.653061	0.902778
8	1OR	0.635294	0.807692
9	4UR	0.626263	0.902778
10	7CH	0.580247	0.984615
11	6SX	0.573171	0.953846
12	6SZ	0.559524	0.984848
13	N6S	0.535354	0.914286
14	N6R	0.535354	0.914286
15	C2E	0.534091	0.902778
16	35G	0.534091	0.888889
17	PCG	0.534091	0.888889
18	1YC	0.53	0.875
19	Y3J	0.506667	0.753623
20	5CD	0.5	0.811594
21	XYA	0.5	0.826087
22	ACK	0.5	0.897059
23	ADN	0.5	0.826087
24	RAB	0.5	0.826087
25	6SW	0.494382	0.9
26	5AD	0.493151	0.776119
27	5N5	0.486842	0.8
28	75G	0.483146	0.890411
29	A4D	0.480519	0.8
30	M2T	0.475	0.736842
31	MTA	0.469136	0.777778
32	CC5	0.466667	0.850746
33	EP4	0.4625	0.756757
34	DTA	0.45679	0.816901
35	QQX	0.452381	0.835616
36	AMP	0.447059	0.927536
37	A	0.447059	0.927536
38	QQY	0.447059	0.847222
39	3DH	0.440476	0.777778
40	AMP MG	0.436782	0.875
41	3AM	0.435294	0.913043
42	ABM	0.431818	0.901408
43	J7C	0.431818	0.75
44	A2D	0.431818	0.928571
45	ZAS	0.430233	0.77027
46	7D7	0.428571	0.771429
47	S4M	0.426966	0.666667
48	6RE	0.425287	0.74026
49	SRA	0.425287	0.876712
50	3AD	0.425	0.838235
51	2AM	0.423529	0.9
52	AP2	0.422222	0.864865
53	A12	0.422222	0.864865
54	BA3	0.422222	0.928571
55	MAO	0.422222	0.740741
56	NEC	0.420455	0.726027
57	A3G	0.420455	0.780822
58	DSH	0.420455	0.727273
59	AOC	0.420455	0.802817
60	BEF ADP	0.419355	0.84
61	SFG	0.419355	0.753425
62	ADP BEF	0.419355	0.84
63	6JR	0.419048	0.927536
64	B4P	0.417582	0.928571
65	5AS	0.417582	0.741176
66	AP5	0.417582	0.928571
67	ADP	0.417582	0.901408
68	A3N	0.41573	0.767123
69	APC	0.414894	0.864865
70	SON	0.413043	0.864865
71	AN2	0.413043	0.888889
72	EEM	0.412371	0.691358
73	GJV	0.411111	0.730769
74	GGZ	0.41	0.78481
75	OVE	0.409091	0.863014
76	ADP MG	0.408602	0.863014
77	AU1	0.408602	0.876712
78	M33	0.408602	0.888889
79	CA0	0.408602	0.876712
80	ADX	0.408602	0.810127
81	A3P	0.406593	0.927536
82	5X8	0.404255	0.767123
83	50T	0.404255	0.888889
84	ATP	0.404255	0.901408
85	ACP	0.404255	0.876712
86	VO4 ADP	0.40404	0.888889
87	ADP VO4	0.40404	0.888889
88	SAM	0.402062	0.691358
89	0UM	0.401961	0.7
90	AQP	0.4	0.901408
91	APR	0.4	0.901408
92	PRX	0.4	0.876712
93	AR6	0.4	0.901408
94	5FA	0.4	0.901408

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

Pocket No.: 1; Query (leader) PDB : 3PNA; Ligand: CMP; Similar sites found: 141

This union binding pocket(no: 1) in the query (biounit: 3pna.bio2) has 15 residues
No:	Leader PDB	Ligand	P-value (APoc)	PS_Score (APoc)	Sequence Similarity
1	5ML3	DL3	0.02005	0.4224	None
2	4WN5	MVC	0.01128	0.41883	None
3	4RYV	ZEA	0.006947	0.40246	None
4	3KA2	2NC	0.04988	0.41107	1.2987
5	4N9I	PCG	0.000000108	0.71195	1.94805
6	3E7O	35F	0.008831	0.4343	1.94805
7	3CRZ	NAP	0.03056	0.41264	1.94805
8	1RE8	BD2	0.04222	0.41127	1.94805
9	1WVC	CTP	0.0249	0.40437	1.94805
10	3MTX	PGT	0.02632	0.41077	1.98676
11	1PN0	IPH	0.03687	0.41762	2.5974
12	1NJR	XYL	0.02398	0.40925	2.5974
13	5CFT	51G	0.02077	0.40542	2.5974
14	4YZC	STU	0.003921	0.45879	3.24675
15	3WV6	GAL BGC	0.005426	0.42679	3.24675
16	3CB2	GDP	0.01219	0.41007	3.24675
17	1PZG	A3D	0.04267	0.40581	3.24675
18	5DQ8	FLF	0.004818	0.43912	3.33333
19	1RQ2	CIT	0.01011	0.42122	3.66492
20	4NFN	2KC	0.003473	0.43481	3.8961
21	4P25	FUC GAL NAG FUC	0.0112	0.41189	3.8961
22	3DAK	ANP	0.01304	0.40457	3.8961
23	4BTK	DTQ	0.01794	0.40177	3.8961
24	4M69	ANP	0.02273	0.4002	3.8961
25	4M0R	644	0.04271	0.41018	4.48549
26	5JKG	6LF	0.003305	0.46385	4.54545
27	5UR1	YY9	0.004386	0.4616	4.54545
28	1ZB6	DIN	0.0173	0.4166	4.54545
29	1T26	NAI	0.04223	0.41045	4.54545
30	4ANW	O92	0.03309	0.40554	4.54545
31	4PLG	NAI	0.04626	0.40391	4.54545
32	3WXM	GTP	0.02414	0.40362	4.54545
33	1IT7	GUN	0.01202	0.40172	4.54545
34	3MWS	017	0.0235	0.41335	5.05051
35	2X2M	X2M	0.001209	0.46573	5.19481
36	5BVE	4VG	0.02388	0.43435	5.19481
37	4C2V	YJA	0.01607	0.4208	5.19481
38	3V8S	0HD	0.01078	0.41072	5.19481
39	3OZ2	OZ2	0.03252	0.40813	5.19481
40	5KEW	6SB	0.01071	0.40909	5.55556
41	5K21	6QF	0.001538	0.44457	5.67376
42	2JLD	AG1	0.01081	0.43219	5.84416
43	4Q0L	V14	0.007982	0.43109	5.84416
44	5TO8	7FM	0.01464	0.43068	5.84416
45	4Y8D	49J	0.000589	0.41572	5.84416
46	2X34	UQ8	0.04086	0.41363	5.84416
47	2EQA	AMP	0.02012	0.40912	5.84416
48	3W0O	ADP	0.02675	0.40803	5.84416
49	4BKJ	STI	0.02221	0.40692	5.84416
50	3F7Z	34O	0.01804	0.40165	5.84416
51	3RG9	WRA	0.02432	0.41989	6.49351
52	3RG9	NDP	0.02139	0.41989	6.49351
53	3TTC	ADP	0.014	0.41565	6.49351
54	4GAH	0ET	0.01965	0.41105	6.49351
55	1WD4	AHR	0.007275	0.40964	6.49351
56	3HZT	J60	0.01063	0.4043	6.49351
57	1T90	NAD	0.03504	0.40423	6.49351
58	2CYE	COA	0.01003	0.41973	6.76692
59	5HES	032	0.003147	0.44495	7.14286
60	2Y8L	ADP	0.0302	0.4246	7.14286
61	3V66	D3A	0.02509	0.42009	7.14286
62	4O1P	ANP	0.00823	0.4185	7.14286
63	3VBK	COA	0.03264	0.4157	7.14286
64	3VBK	0FX	0.03642	0.41559	7.14286
65	5LXC	7AA	0.008959	0.41252	7.14286
66	4D4U	FUC GAL	0.01244	0.41031	7.14286
67	1Q8Y	ADE	0.007266	0.40966	7.14286
68	1KRR	ACO	0.02722	0.40639	7.14286
69	4LNU	GDP	0.01112	0.41913	7.5388
70	5FBN	5WF	0.003367	0.45862	7.79221
71	4CQE	CQE	0.003663	0.44166	7.79221
72	3SXS	PP2	0.001175	0.46437	8.44156
73	3THR	C2F	0.00262	0.44081	8.44156
74	1KQF	MGD	0.01036	0.43544	8.44156
75	4USF	6UI	0.01066	0.42166	8.44156
76	3VPD	ANP	0.01119	0.41736	8.44156
77	2V7O	DRN	0.006252	0.41277	8.44156
78	3G5D	1N1	0.003308	0.47811	9.09091
79	2OFV	242	0.004581	0.45408	9.09091
80	2HK5	1BM	0.00369	0.43964	9.09091
81	3FW3	ETS	0.004943	0.43142	9.09091
82	3NTY	NAP	0.04086	0.40865	9.09091
83	3NTY	5P3	0.04241	0.40865	9.09091
84	3HXU	A5A	0.02105	0.40512	9.09091
85	2VN9	GVD	0.01102	0.40103	9.09091
86	5MJA	7O3	0.008655	0.41742	9.74026
87	2X32	OTP	0.04227	0.41282	9.74026
88	4EUU	BX7	0.02432	0.40629	9.74026
89	5JFS	6K0	0.002968	0.46854	10.3896
90	1EBG	PAH	0.004713	0.43244	10.3896
91	5N87	N66	0.01263	0.43092	10.3896
92	2BL9	CP6	0.02477	0.41751	10.3896
93	4OAV	ACP	0.008662	0.41537	10.3896
94	1LSH	PLD	0.02146	0.41301	10.3896
95	1R27	MGD	0.04509	0.40357	10.3896
96	2F1K	NAP	0.03108	0.40212	10.3896
97	4ASE	AV9	0.00163	0.46784	11.039
98	3VHE	42Q	0.005511	0.44359	11.039
99	1YZX	GSF	0.01053	0.41121	11.039
100	2CWH	NDP	0.03678	0.4008	11.039
101	5U98	1KX	0.01919	0.43899	11.1111
102	1SIV	PSI	0.03671	0.40426	11.1111
103	3L9R	L9R	0.007594	0.44139	11.2245
104	1FMB	HYB	0.01156	0.4049	11.5385
105	1DMR	PGD	0.03284	0.43137	11.6883
106	3FGC	FMN	0.01269	0.41289	11.6883
107	3CKJ	CIT	0.01699	0.41568	12.3377
108	4HXY	NDP	0.03878	0.4019	12.3377
109	1GR0	NAD	0.04531	0.40149	12.3377
110	1KGQ	NPI	0.02539	0.42576	13.6364
111	1KGQ	SCO	0.02623	0.42576	13.6364
112	5VC5	96M	0.001135	0.47588	14.2857
113	4YEE	4CQ	0.007922	0.41267	14.4444
114	3RUG	DB6	0.02091	0.42957	14.9351
115	3EEL	53T	0.03194	0.41533	16.2338
116	4MOB	COA	0.02606	0.40336	18.1818
117	5W4W	9WG	0.002798	0.45878	18.8312
118	1H0H	2MD	0.033	0.4056	20.1299
119	1OUK	084	0.005731	0.48731	20.7792
120	4LOO	SB4	0.01211	0.41021	20.7792
121	3LA3	2FT	0.00154	0.42829	25.974
122	2XKO	AKG	0.0011	0.43442	26.6234
123	2XHK	AKG	0.002122	0.42929	26.6234
124	4AVB	CMP	0.00000001014	0.69701	27.2727
125	2WEI	VGG	0.0008831	0.46144	27.9221
126	4CYD	CMP	0.0000007768	0.53248	29.2208
127	3I59	N6S	0.000000137	0.65669	31.1688
128	3I59	N6R	0.0000001467	0.65523	31.1688
129	3I54	CMP	0.000001573	0.59819	31.1688
130	5H5O	PCG	0.000001141	0.54737	32.5581
131	3KCC	CMP	0.00000004644	0.67992	33.1169
132	4KU7	PCG	0.0000000000152	0.76081	34.6405
133	4NVP	7CH	0.0000000000762	0.70339	35.0649
134	4MUV	PCG	0.0000000001107	0.80103	35.2113
135	3CF6	SP1	0.000000003173	0.72984	36.3636
136	5BV6	35G	0.00000000002875	0.83847	38.1579
137	5KJZ	PCG	0.00000000004002	0.82261	38.6667
138	5JAX	6J7	0.00000000001992	0.70624	39.2593
139	5K8S	CMP	0.0000000004116	0.63802	39.8649
140	3SHR	CMP	0.0000000001429	0.747	44.1558
141	4OFG	PCG	0.0000000001007	0.72597	45.1389

Pocket No.: 2; Query (leader) PDB : 3PNA; Ligand: CMP; Similar sites found: 30

This union binding pocket(no: 2) in the query (biounit: 3pna.bio1) has 15 residues
No:	Leader PDB	Ligand	P-value (APoc)	PS_Score (APoc)	Sequence Similarity
1	1H6W	SER LEU ASN TYR ILE ILE LYS VAL LYS GLU	0.02159	0.41644	2.5974
2	5CFT	APC	0.02032	0.40264	2.5974
3	2XK9	XK9	0.01395	0.42865	3.24675
4	2V3V	MGD	0.04794	0.42409	3.24675
5	3CTL	S6P	0.01891	0.40422	3.24675
6	1LN1	DLP	0.04181	0.40127	3.24675
7	3OZG	SSI	0.01767	0.40016	3.24675
8	2GJ5	VD3	0.04438	0.40394	3.8961
9	4Y0X	ADP	0.006866	0.41815	4.26667
10	5HCY	60D	0.005242	0.45844	4.54545
11	2YAK	OSV	0.002247	0.46368	5.19481
12	4GUT	FAD	0.03988	0.41498	5.19481
13	3WCZ	NAP	0.03163	0.40542	5.19481
14	2YMZ	LAT	0.024	0.40084	6.15385
15	4QTB	38Z	0.02434	0.40891	6.49351
16	5AHW	CMP	0.0168	0.40123	6.80272
17	1PK8	ATP	0.0272	0.40241	7.14286
18	4OB6	S2T	0.01601	0.40226	7.14286
19	4WOE	3S5	0.006565	0.41903	7.79221
20	4MZU	COA	0.02793	0.40037	8.44156
21	2H8H	H8H	0.01556	0.40483	9.09091
22	1P9P	SAH	0.02068	0.40552	9.74026
23	1ELI	PYC	0.04953	0.40231	10.3896
24	2HJR	APR	0.02571	0.40221	10.3896
25	2CWH	PYC	0.03224	0.40833	11.039
26	4JGT	PYR	0.009299	0.4231	12.3377
27	2D4V	NAD	0.03158	0.40304	12.3377
28	5K2M	ADP	0.02597	0.40199	16.2338
29	2PZI	AXX	0.005348	0.40098	17.5325
30	4FG8	ATP	0.02236	0.40056	18.1818

Pocket No.: 3; Query (leader) PDB : 3PNA; Ligand: CMP; Similar sites found: 593

This union binding pocket(no: 3) in the query (biounit: 3pna.bio3) has 15 residues
No:	Leader PDB	Ligand	P-value (APoc)	PS_Score (APoc)	Sequence Similarity
1	1BTN	I3P	0.001011	0.48965	None
2	2F01	BTQ	0.001354	0.47991	None
3	1UO5	PIH	0.002138	0.47036	None
4	2Q3M	MLA	0.0009523	0.46695	None
5	1Y9Q	MED	0.0005632	0.45146	None
6	4LSJ	LSJ	0.0008483	0.44359	None
7	2DTX	BMA	0.003335	0.44269	None
8	2DVZ	GLU	0.0004096	0.43929	None
9	2VKL	MLT	0.00566	0.43832	None
10	3S9K	CIT	0.008326	0.4375	None
11	3R35	4CO	0.002806	0.43652	None
12	2WCV	FUC	0.000406	0.43638	None
13	1D3V	ABH	0.002453	0.43174	None
14	2VQ5	LDP	0.006158	0.42802	None
15	2F01	BTN	0.01821	0.42745	None
16	4P3H	25G	0.009944	0.42651	None
17	2IYG	FMN	0.0002275	0.42457	None
18	3U5S	FAD	0.002902	0.42193	None
19	3RF4	FUN	0.001511	0.42041	None
20	1UW1	ADP	0.002145	0.42039	None
21	1U5R	ATP	0.0000926	0.41977	None
22	1NN5	ANP	0.006901	0.41862	None
23	1NN5	2DT	0.006901	0.41862	None
24	4Q3R	XA2	0.005293	0.41787	None
25	2ALG	HP6	0.003684	0.41772	None
26	2ALG	DAO	0.003684	0.41772	None
27	1UWZ	THU	0.002397	0.41712	None
28	4C0X	AQN	0.00855	0.41593	None
29	3JQM	GTP	0.001427	0.41559	None
30	3OIG	NAD	0.02837	0.4154	None
31	4B16	NAG	0.0165	0.41485	None
32	4K7O	EKZ	0.0003379	0.41282	None
33	3OIG	IMJ	0.01327	0.41012	None
34	2Q37	3AL	0.003957	0.40951	None
35	1FW1	GSH	0.0005608	0.40827	None
36	1NNS	ASP	0.001364	0.40808	None
37	2C4I	BTN	0.004777	0.40529	None
38	2AEB	ABH	0.01797	0.40499	None
39	4C0X	FMN	0.01209	0.40435	None
40	3PMD	11A	0.001853	0.40332	None
41	4BCS	BTN	0.005428	0.4031	None
42	5YAS	FAC	0.003613	0.40291	None
43	4F4S	EFO	0.004267	0.40262	None
44	3CBG	SAH	0.006629	0.40173	None
45	3RKR	NAP	0.004002	0.4012	None
46	1YRX	FMN	0.0003519	0.40065	None
47	2UZ2	BTN	0.003324	0.41152	0.769231
48	2PT9	S4M	0.001377	0.44214	1.2987
49	1A8R	GTP	0.00105	0.43785	1.2987
50	1H2B	NAJ	0.003577	0.43457	1.2987
51	2PT9	2MH	0.009257	0.41799	1.2987
52	4IVG	ANP	0.0199	0.41698	1.2987
53	4EKV	BTN	0.01026	0.41494	1.2987
54	4G1V	FAD	0.007409	0.41465	1.2987
55	2QLX	RM4	0.006976	0.41123	1.85185
56	1U7Z	PMT	0.0005363	0.46985	1.94805
57	3BL6	FMC	0.0003415	0.45528	1.94805
58	2YVF	NAD	0.008502	0.44094	1.94805
59	2YVF	FAD	0.008224	0.44094	1.94805
60	1TOI	HCI	0.001943	0.4405	1.94805
61	4JCA	CIT	0.00609	0.43671	1.94805
62	3HY3	10F	0.002099	0.43123	1.94805
63	3K9W	4PS	0.03348	0.42671	1.94805
64	3K9W	ADE	0.03348	0.42671	1.94805
65	1P72	ADP	0.008875	0.41524	1.94805
66	1NU4	MLA	0.02465	0.40601	2.06186
67	2OFD	NGA	0.003778	0.4164	2.11268
68	2OFE	NAG	0.008084	0.40236	2.11268
69	1JGS	SAL	0.004706	0.45223	2.17391
70	3RO7	TDR	0.004679	0.42303	2.26415
71	2YLD	CMO	0.005912	0.40814	2.3622
72	1HEX	NAD	0.0001204	0.48962	2.5974
73	1LTH	NAD	0.001529	0.46904	2.5974
74	4N02	FNR	0.001578	0.46841	2.5974
75	1J5P	NAD	0.0005114	0.46332	2.5974
76	2J7T	274	0.0007338	0.4583	2.5974
77	3WBF	NAP	0.0009773	0.45306	2.5974
78	3WBF	API	0.001446	0.45141	2.5974
79	2H6B	3C4	0.007786	0.43851	2.5974
80	3MBG	FAD	0.002575	0.43086	2.5974
81	2OYS	FMN	0.001785	0.4305	2.5974
82	4B7J	G39	0.005209	0.42757	2.5974
83	3CEV	ARG	0.0007336	0.4266	2.5974
84	1QH9	LAC	0.002367	0.42502	2.5974
85	3ZY6	GFB	0.002948	0.42165	2.5974
86	2A0W	DIH	0.007699	0.42087	2.5974
87	3KJI	ADP	0.002829	0.41428	2.5974
88	1PKK	DCP	0.0071	0.40785	2.5974
89	2Y6P	CTP	0.002226	0.40034	2.5974
90	2BOI	MFU	0.001435	0.42129	2.65487
91	1B8U	NAD	0.0006472	0.44836	2.73556
92	1B8U	OAA	0.001589	0.44836	2.73556
93	1C1L	GAL BGC	0.0002425	0.47559	2.91971
94	1Y1A	GSH	0.00003223	0.57275	3.24675
95	3R51	MMA	0.0007041	0.47324	3.24675
96	1XMV	ADP	0.006666	0.43928	3.24675
97	3IOI	1GW	0.003096	0.436	3.24675
98	3M6W	SAM	0.0007982	0.43597	3.24675
99	1O6B	ADP	0.00637	0.43513	3.24675
100	1WUR	8DG	0.001597	0.43432	3.24675
101	4I9A	NCN	0.002826	0.43365	3.24675
102	1ZGA	HMK	0.0007045	0.43301	3.24675
103	1BGQ	RDC	0.00285	0.43057	3.24675
104	2PJL	047	0.004886	0.42936	3.24675
105	4TMK	T5A	0.04051	0.42725	3.24675
106	4LIT	AKG	0.001737	0.42413	3.24675
107	1Y13	BIO	0.00102	0.42405	3.24675
108	3ZLM	ANP	0.002371	0.42159	3.24675
109	3ACC	5GP	0.001011	0.4213	3.24675
110	2V7T	SAH	0.04129	0.42012	3.24675
111	3H22	B53	0.001404	0.41871	3.24675
112	2QIA	U20	0.02057	0.41815	3.24675
113	1ZGA	SAH	0.002061	0.41738	3.24675
114	2PUL	ACP	0.002521	0.41626	3.24675
115	4KCT	FDP	0.000489	0.4159	3.24675
116	4MWV	BCZ	0.01281	0.41507	3.24675
117	4HZX	G39	0.01595	0.41286	3.24675
118	2J0W	ADP	0.004012	0.41042	3.24675
119	2J0W	ASP	0.0003664	0.40985	3.24675
120	2I4O	ATP	0.002451	0.4094	3.24675
121	3P0K	FAD	0.007854	0.40605	3.24675
122	3E81	SLB	0.005044	0.40519	3.24675
123	4NAO	AKG	0.009621	0.40505	3.24675
124	4CIB	7UZ	0.001257	0.40369	3.24675
125	1XNK	XS2	0.005493	0.4029	3.24675
126	1Q11	TYE	0.004787	0.40065	3.24675
127	1ULE	GLA GAL NAG	0.002946	0.42099	3.33333
128	4Q3F	TLA	0.004048	0.41513	3.4188
129	1IS3	LAT	0.00005994	0.42717	3.7037
130	1POC	GEL	0.006979	0.40084	3.73134
131	4NTD	FAD	0.0009036	0.46636	3.82353
132	2GSD	NAD	0.0007604	0.46597	3.8961
133	3F3E	LEU	0.000999	0.46329	3.8961
134	2Q8H	TF4	0.001248	0.46131	3.8961
135	1NZY	BCA	0.0006104	0.4601	3.8961
136	4BAS	GNP	0.0003375	0.45982	3.8961
137	3Q9T	FAY	0.001564	0.45598	3.8961
138	2XVE	FAD	0.004252	0.45484	3.8961
139	1Q0H	NDP	0.004012	0.44674	3.8961
140	1Q0H	FOM	0.004367	0.44333	3.8961
141	4PO2	ASN ARG LEU LEU LEU THR GLY	0.0009925	0.44274	3.8961
142	3FXU	TSU	0.001591	0.43789	3.8961
143	1UBY	DMA	0.0008309	0.43761	3.8961
144	2HGS	ADP	0.001728	0.43292	3.8961
145	1JUV	NDP	0.002556	0.43255	3.8961
146	1VJO	PLP	0.0009867	0.43233	3.8961
147	3A8U	PLP	0.002549	0.42944	3.8961
148	1ZUW	DGL	0.0006622	0.42829	3.8961
149	1QW9	KHP	0.003188	0.42702	3.8961
150	1KOL	NAD	0.00668	0.42634	3.8961
151	3ZRR	PXG	0.002075	0.42592	3.8961
152	3LTW	HLZ	0.002266	0.42582	3.8961
153	1V1A	ADP	0.004455	0.42532	3.8961
154	1ECC	PCP	0.003181	0.42382	3.8961
155	1F8F	NAD	0.01641	0.42371	3.8961
156	3ICC	NAP	0.00612	0.42336	3.8961
157	4CCN	OGA	0.002828	0.42174	3.8961
158	3WCS	MAN NAG	0.0006843	0.42117	3.8961
159	2P41	SAH	0.002504	0.42064	3.8961
160	3RGG	AIR	0.001305	0.41993	3.8961
161	3K56	IS3	0.002149	0.41667	3.8961
162	3GWT	066	0.008597	0.41583	3.8961
163	2R42	FPS	0.003842	0.41513	3.8961
164	2JE7	XMM	0.006816	0.41476	3.8961
165	2G36	TRP	0.0008343	0.4123	3.8961
166	1LYX	PGA	0.0004567	0.41156	3.8961
167	4C2G	ALA ALA ALA ALA	0.00187	0.41112	3.8961
168	4G10	GSH	0.003525	0.41051	3.8961
169	1XX4	BAM	0.00333	0.40967	3.8961
170	4E28	9MZ	0.005521	0.4094	3.8961
171	2F5T	MAL	0.004988	0.40865	3.8961
172	3WCS	MAN NAG GAL	0.002699	0.40779	3.8961
173	4CCO	OGA	0.003211	0.4075	3.8961
174	3QV1	NAD	0.01207	0.40704	3.8961
175	4M7F	BM3	0.00331	0.40698	3.8961
176	2HGS	GSH	0.003969	0.40623	3.8961
177	3A2Q	ACA ACA	0.005305	0.40559	3.8961
178	1V1A	KDG	0.007931	0.40331	3.8961
179	1NXJ	TLA	0.0003777	0.40049	3.8961
180	1OWB	NAD	0.01955	0.4	3.8961
181	1SS4	GSH	0.0006078	0.50653	3.92157
182	2E1A	MSE	0.001281	0.41738	4
183	2GJ3	FAD	0.002203	0.42861	4.16667
184	1TUV	VK3	0.006181	0.42794	4.38596
185	1DUC	DUD	0.0003455	0.45836	4.47761
186	2PTZ	PAH	0.00004533	0.48509	4.54545
187	4PLG	OXM	0.0004062	0.48027	4.54545
188	2NLI	LAC	0.001065	0.47439	4.54545
189	2NLI	FMN	0.001065	0.47439	4.54545
190	3PNL	ADP	0.0002017	0.47097	4.54545
191	1T26	GBD	0.004502	0.46852	4.54545
192	4O8A	2OP	0.001595	0.45621	4.54545
193	4KCF	AKM	0.0005317	0.4557	4.54545
194	2AMV	BIN	0.003481	0.45122	4.54545
195	1Y7P	RIP	0.001359	0.45064	4.54545
196	1VDC	FAD	0.003448	0.44969	4.54545
197	1LVL	FAD	0.003706	0.44466	4.54545
198	1LVL	NAD	0.0009227	0.44211	4.54545
199	1UAY	ADN	0.0006598	0.43674	4.54545
200	2IMP	NAI	0.01611	0.43605	4.54545
201	1TUF	AZ1	0.002194	0.43213	4.54545
202	1TRD	PGH	0.0007854	0.43118	4.54545
203	1OAA	OAA	0.007776	0.43037	4.54545
204	1E7S	NAP	0.004592	0.42869	4.54545
205	3IB8	AMP	0.001234	0.4261	4.54545
206	3B9Z	CO2	0.002477	0.42418	4.54545
207	3JDW	ORN	0.002222	0.41842	4.54545
208	1NVU	GTP	0.02164	0.4182	4.54545
209	3U4C	NDP	0.006744	0.41773	4.54545
210	1HQL	GLA MBG	0.0001753	0.41441	4.54545
211	1PFK	ADP	0.003402	0.41112	4.54545
212	4JP3	CIT	0.0006499	0.41017	4.54545
213	4KCF	FMN	0.00362	0.41005	4.54545
214	1V2G	OCA	0.002768	0.40994	4.54545
215	1T8U	A3P	0.005226	0.40974	4.54545
216	2QS8	MET	0.01049	0.40963	4.54545
217	4WX0	HXD	0.003946	0.40858	4.54545
218	4LWA	Q13	0.02089	0.40769	4.54545
219	1R0X	ATP	0.01596	0.40667	4.54545
220	4FGC	PQ0	0.001109	0.40488	4.54545
221	1F5F	DHT	0.0003107	0.40277	4.54545
222	4P05	4NS	0.009568	0.40254	4.54545
223	2D37	FMN	0.0134	0.40248	4.54545
224	2D37	NAD	0.01442	0.40248	4.54545
225	1WHT	BZS	0.0008003	0.40168	4.54545
226	2VWT	PYR	0.0003798	0.40149	4.54545
227	1KYQ	NAD	0.0001995	0.40056	4.54545
228	1ZED	PNP	0.01221	0.40047	4.54545
229	1OGD	RIP	0.003683	0.40514	4.58015
230	3TCT	3MI	0.04027	0.4044	4.72441
231	3TA2	ATP	0.001714	0.44889	5.08475
232	4COQ	SAN	0.00004979	0.49612	5.19481
233	1QJC	PNS	0.0004332	0.49427	5.19481
234	3CQD	ATP	0.0003191	0.48482	5.19481
235	2ZWS	PLM	0.00134	0.48108	5.19481
236	1JIL	485	0.0001903	0.46772	5.19481
237	1EDO	NAP	0.004072	0.45965	5.19481
238	3B1F	NAD	0.0005427	0.45344	5.19481
239	2P1M	IHP	0.0008804	0.4502	5.19481
240	1UXG	FUM	0.002149	0.44996	5.19481
241	1UXG	NAD	0.002149	0.44996	5.19481
242	3OND	NAD	0.003738	0.44812	5.19481
243	3OND	ADN	0.003738	0.44812	5.19481
244	1IUP	ALQ	0.001469	0.44706	5.19481
245	2OI2	DP6	0.0003795	0.44343	5.19481
246	2X61	CH	0.004187	0.43836	5.19481
247	1XE7	GUN	0.004164	0.43619	5.19481
248	2EFJ	SAH	0.001013	0.4342	5.19481
249	2P1O	IHP	0.003512	0.43105	5.19481
250	2P1O	NLA	0.003512	0.43105	5.19481
251	1P9B	GDP	0.001217	0.43102	5.19481
252	2DWU	DGL	0.0006359	0.42896	5.19481
253	1P9B	IMO	0.003787	0.42234	5.19481
254	4AAW	R84	0.01577	0.42002	5.19481
255	4N7C	AEF	0.004489	0.41969	5.19481
256	3DAG	FEG	0.004813	0.41958	5.19481
257	2CKM	AA7	0.01571	0.415	5.19481
258	2Z9V	PXM	0.002116	0.41464	5.19481
259	1P9B	HDA	0.0006898	0.41405	5.19481
260	3S2Y	FMN	0.003718	0.41377	5.19481
261	2QGI	UDP	0.0007774	0.41333	5.19481
262	1VJT	NAD	0.004767	0.41135	5.19481
263	2EWM	NAD	0.01112	0.41108	5.19481
264	1FDJ	13P	0.0003487	0.41104	5.19481
265	4USS	GSH	0.00125	0.41047	5.19481
266	1NML	CIT	0.001386	0.41039	5.19481
267	4QN7	G39	0.01767	0.40692	5.19481
268	3U1T	MLI	0.01008	0.40415	5.19481
269	1SBZ	FMN	0.01728	0.40405	5.19481
270	4M37	SAH	0.00006889	0.40328	5.19481
271	2EFJ	37T	0.001977	0.4032	5.19481
272	1UZN	NAP	0.005877	0.40174	5.19481
273	1UJ5	5RP	0.004657	0.40116	5.19481
274	5FIT	AP2	0.002595	0.41103	5.44218
275	3EM1	TYD	0.009644	0.40478	5.47945
276	1MVN	PCO	0.001043	0.47947	5.84416
277	2CSN	CKI	0.0002453	0.47321	5.84416
278	2YGN	PCF	0.0005302	0.46424	5.84416
279	3L6R	MLI	0.0004816	0.46245	5.84416
280	1NW5	SAM	0.0006669	0.44579	5.84416
281	4HA6	FAD	0.003664	0.44488	5.84416
282	2HFK	E4H	0.0003912	0.44354	5.84416
283	3DCM	SAM	0.000759	0.44352	5.84416
284	1X1T	NAD	0.009979	0.44262	5.84416
285	1B74	DGN	0.002368	0.43956	5.84416
286	2ZJ5	ADP	0.0009398	0.43503	5.84416
287	4B9E	FAH	0.002075	0.43448	5.84416
288	1WDA	BAG	0.000459	0.43435	5.84416
289	1T57	FMN	0.001764	0.43255	5.84416
290	3BHO	B4P	0.007557	0.43199	5.84416
291	1XVV	CCQ	0.005937	0.43172	5.84416
292	4RJK	PYR	0.003545	0.4315	5.84416
293	2EB5	OXL	0.001718	0.43092	5.84416
294	4UP4	GAL NAG	0.01217	0.42638	5.84416
295	1ZFJ	IMP	0.03868	0.42404	5.84416
296	3SSO	SAH	0.002661	0.42346	5.84416
297	4GQB	0XU	0.01736	0.42116	5.84416
298	1MVN	FMN	0.01206	0.41723	5.84416
299	3HZS	M0E	0.01498	0.41592	5.84416
300	1GEX	PLP HSA	0.006926	0.41301	5.84416
301	2PNZ	UDP	0.007593	0.41135	5.84416
302	4C0C	WVH	0.02174	0.41131	5.84416
303	2QQF	A1R	0.007651	0.41121	5.84416
304	2B4Q	NAP	0.01167	0.40894	5.84416
305	4K5S	PM0	0.03095	0.40751	5.84416
306	3H86	AP5	0.02987	0.4063	5.84416
307	1I7L	ATP	0.009874	0.40358	5.84416
308	4DVE	BTN	0.004054	0.40099	5.84416
309	4K5S	FAD	0.0221	0.40057	5.84416
310	4U9W	COA	0.0002053	0.40051	5.84416
311	1GVF	PGH	0.002436	0.40013	5.84416
312	4G28	0W8	0.0004887	0.43332	5.88235
313	4WNB	4BN	0.006757	0.4014	6.20155
314	2HJ3	FAD	0.006984	0.40643	6.4
315	4KQI	NIO	0.0002663	0.47993	6.49351
316	4KQI	RBZ	0.0002663	0.47993	6.49351
317	3BW2	FMN	0.0003954	0.47115	6.49351
318	4WVH	ASP HIS ASP ALA HIS ALA	0.00008786	0.46169	6.49351
319	3PFG	TLO	0.001387	0.46046	6.49351
320	3PFG	SAM	0.001387	0.46046	6.49351
321	1R18	SAH	0.0003728	0.46009	6.49351
322	4OYA	1VE	0.009944	0.45369	6.49351
323	3LZW	NAP	0.004318	0.45241	6.49351
324	3LZW	FAD	0.002076	0.45061	6.49351
325	2GDZ	NAD	0.001258	0.4499	6.49351
326	9LDB	NAD	0.001448	0.44872	6.49351
327	3BRE	C2E	0.0006757	0.44811	6.49351
328	3PY5	AMP	0.0004564	0.44554	6.49351
329	9LDT	OXM	0.004088	0.44543	6.49351
330	1ITZ	TPP	0.001127	0.44232	6.49351
331	4IAE	1DX	0.006212	0.43946	6.49351
332	1JQ5	NAD	0.03053	0.43786	6.49351
333	4R33	TRP	0.004403	0.4307	6.49351
334	4R33	SAH	0.004403	0.4307	6.49351
335	2QDT	I38	0.001108	0.43034	6.49351
336	4QVH	COA	0.003978	0.42527	6.49351
337	1QF5	GDP	0.01222	0.42501	6.49351
338	1QF5	RPL	0.01222	0.42501	6.49351
339	2NT8	ATP	0.004831	0.42384	6.49351
340	1E2S	CSN	0.001419	0.42373	6.49351
341	4F2Q	QUS	0.001484	0.42297	6.49351
342	3FS8	TDR	0.02829	0.42259	6.49351
343	3ZTV	ADN	0.001795	0.41973	6.49351
344	4RNV	FMN	0.001645	0.41606	6.49351
345	1PX8	XYP	0.002813	0.41557	6.49351
346	4A3R	CIT	0.01189	0.41439	6.49351
347	2OWZ	CIT	0.004259	0.41419	6.49351
348	3FS8	ACO	0.04994	0.41151	6.49351
349	4M51	BEZ	0.01014	0.41048	6.49351
350	1QB7	ADE	0.002371	0.40995	6.49351
351	4IS0	1R4	0.007275	0.40741	6.49351
352	1T0S	BML	0.01204	0.40703	6.49351
353	1OTH	PAO	0.01535	0.40626	6.49351
354	4ARF	IP8 GLY PRO ALA	0.004642	0.40578	6.49351
355	3Q3C	NAD	0.04212	0.4035	6.49351
356	2Q8M	AMP	0.001231	0.40235	6.49351
357	3WO0	ADP	0.02568	0.40086	6.49351
358	3WO0	ALA	0.02568	0.40086	6.49351
359	2D4N	DUP	0.001496	0.43814	6.57895
360	1M5B	BN1	0.0003382	0.50221	7.14286
361	1Z42	HBA	0.001317	0.48538	7.14286
362	1ZK7	FAD	0.001004	0.47179	7.14286
363	3ZPG	5GP	0.001009	0.46573	7.14286
364	1YS4	NAP	0.0003337	0.46205	7.14286
365	3O03	NAP	0.0006063	0.4586	7.14286
366	1TDF	FAD	0.002878	0.45232	7.14286
367	1IYE	PGU	0.001425	0.44901	7.14286
368	1TDF	NAP	0.008052	0.447	7.14286
369	4IOK	ADP	0.001195	0.44632	7.14286
370	2YIV	NBN	0.001301	0.44342	7.14286
371	1Z44	NPO	0.007407	0.4418	7.14286
372	1PEA	ACM	0.002275	0.44036	7.14286
373	1H9G	COA MYR	0.001761	0.43929	7.14286
374	1F74	NAY	0.0008043	0.43584	7.14286
375	4BMO	FMN	0.002174	0.43392	7.14286
376	1L1Q	9DA	0.001429	0.43245	7.14286
377	3K3G	MMU	0.001001	0.43062	7.14286
378	4IOK	XPO	0.00238	0.42899	7.14286
379	2BGM	NAJ	0.01525	0.42655	7.14286
380	3MD0	GDP	0.0008883	0.42344	7.14286
381	4O1M	NAD	0.005352	0.4233	7.14286
382	1V7R	CIT	0.01179	0.42224	7.14286
383	4AF5	CIT	0.002753	0.42224	7.14286
384	3FSJ	D7K	0.03215	0.41755	7.14286
385	4LTN	NAI	0.0188	0.41657	7.14286
386	4LTN	FMN	0.01667	0.41563	7.14286
387	1G8S	MET	0.004126	0.41477	7.14286
388	1R89	CTP	0.003285	0.41172	7.14286
389	2VJJ	RAM GLC GAL NAG NAG GLC	0.02745	0.41025	7.14286
390	1MXI	SAH	0.00008925	0.40959	7.14286
391	1AUX	AGS	0.004409	0.40879	7.14286
392	1VPM	COA	0.009136	0.40497	7.14286
393	3O03	GCO	0.00483	0.40289	7.14286
394	3IL6	B83	0.008155	0.40193	7.14286
395	4AIG	FLX	0.003915	0.40157	7.14286
396	3UEC	ALA ARG TPO LYS	0.002988	0.4275	7.53425
397	2HMT	NAI	0.009684	0.42956	7.63889
398	2VBQ	BSJ	0.0005579	0.47047	7.79221
399	3ZS7	ATP	0.0004579	0.45645	7.79221
400	2BZ1	TAU	0.00495	0.45107	7.79221
401	1HDR	NAD	0.005667	0.44085	7.79221
402	2HVW	DDN	0.0008664	0.43211	7.79221
403	1X54	4AD	0.00254	0.4295	7.79221
404	1YOA	FMN	0.01661	0.42317	7.79221
405	1PR9	NAP	0.006655	0.42301	7.79221
406	3D3W	NAP	0.00664	0.42061	7.79221
407	1JA9	PYQ	0.005854	0.42032	7.79221
408	3DDN	HPV	0.000502	0.41683	7.79221
409	2WE5	ADP	0.003183	0.40999	7.79221
410	1JA9	NDP	0.04779	0.40937	7.79221
411	1QS0	TDP	0.006233	0.40665	7.79221
412	4LHM	AZZ	0.004901	0.40571	7.79221
413	1QRD	FAD	0.009125	0.405	7.79221
414	1SC3	MLI	0.004137	0.42841	7.95455
415	3T2W	BTN	0.001029	0.4239	8.19672
416	2W3L	DRO	0.01358	0.41148	8.33333
417	3NCQ	ATP	0.001686	0.43149	8.40336
418	1RYI	GOA	0.002809	0.47453	8.44156
419	3FPZ	AHZ	0.004018	0.46467	8.44156
420	4NE2	SH2	0.00103	0.46029	8.44156
421	3KYF	5GP 5GP	0.0001413	0.45705	8.44156
422	4NE2	ADP	0.001594	0.44961	8.44156
423	1SQ5	PAU	0.0004657	0.44056	8.44156
424	3QV9	QV7	0.0008846	0.4361	8.44156
425	1IM8	SAI	0.001481	0.43378	8.44156
426	3DDC	GNP	0.00244	0.43183	8.44156
427	1D6H	COA	0.007775	0.43038	8.44156
428	1CL2	PPG	0.001875	0.4277	8.44156
429	1QO0	BMD	0.002095	0.42727	8.44156
430	2YBQ	UP2	0.008147	0.42259	8.44156
431	2VDJ	HSE	0.006665	0.41888	8.44156
432	2ZJF	BSU	0.0007655	0.41797	8.44156
433	1YAG	ATP	0.00562	0.41366	8.44156
434	2YBQ	SAH	0.004197	0.41358	8.44156
435	3VKX	T3	0.00448	0.41337	8.44156
436	4HZO	COA	0.002818	0.40974	8.44156
437	1LC8	33P	0.009217	0.40928	8.44156
438	1SQ5	ADP	0.0008591	0.4083	8.44156
439	3BY8	MLT	0.003135	0.42657	8.4507
440	2NS1	ADP	0.0002757	0.48292	8.62069
441	1TU3	GNP	0.0006051	0.45695	8.86076
442	1DLJ	NAI	0.001094	0.47386	9.09091
443	2C7G	FAD	0.001689	0.46953	9.09091
444	1LDM	NAD	0.002689	0.46541	9.09091
445	1V5F	FAD	0.02004	0.45086	9.09091
446	1V5F	TPP	0.02004	0.45086	9.09091
447	1DSS	NAD	0.001792	0.4374	9.09091
448	1DLJ	UGA	0.008383	0.43399	9.09091
449	1GAD	NAD	0.002674	0.43173	9.09091
450	2FWP	CIT	0.004743	0.42683	9.09091
451	4A6D	SAM	0.003189	0.4184	9.09091
452	1I9G	SAM	0.02115	0.41266	9.09091
453	2FWP	ICR	0.01368	0.41175	9.09091
454	2C7G	ODP	0.03031	0.41146	9.09091
455	3ZGE	ASP	0.009744	0.41128	9.09091
456	3AHC	TPP	0.01145	0.40929	9.09091
457	3RHZ	UDP	0.007315	0.40198	9.09091
458	2WGC	SIA GAL BGC	0.04317	0.40095	9.09091
459	4LXH	C1E	0.007323	0.40001	9.09091
460	1XHL	NDP	0.003846	0.43198	9.42761
461	1XHL	TNE	0.0004398	0.41033	9.42761
462	3TKA	CTN	0.0002137	0.53585	9.74026
463	1TIW	TFB	0.0002921	0.48773	9.74026
464	1TIW	FAD	0.0002921	0.48773	9.74026
465	1YOE	RIB	0.0000725	0.46487	9.74026
466	1KBJ	FMN	0.0005805	0.4577	9.74026
467	1EXB	NDP	0.006475	0.45145	9.74026
468	2NX1	PEP	0.001424	0.4447	9.74026
469	2NX1	RP5	0.00148	0.44399	9.74026
470	2BNE	U5P	0.002524	0.44168	9.74026
471	2PWY	SAH	0.001243	0.44057	9.74026
472	2B7N	NTM	0.0008184	0.43748	9.74026
473	2HW1	ANP	0.001832	0.43003	9.74026
474	2QCX	PF1	0.00128	0.42955	9.74026
475	1YBH	CIE	0.008358	0.4252	9.74026
476	1SOW	NAD	0.005625	0.42493	9.74026
477	1YBH	FAD	0.01144	0.41921	9.74026
478	2VAR	AMP	0.0006578	0.4189	9.74026
479	3VHZ	L2P GLC MAN SGA	0.0361	0.41434	9.74026
480	1YBH	P22	0.001852	0.41409	9.74026
481	2JFV	FLC	0.008487	0.40146	10.3093
482	3MAG	3MA	0.0002611	0.50548	10.3896
483	2YC5	6BC	0.0005508	0.47201	10.3896
484	1V2X	SAM	0.0003077	0.45932	10.3896
485	1GPJ	CIT	0.0004583	0.45526	10.3896
486	3MB5	SAM	0.004834	0.44478	10.3896
487	1H16	PYR	0.002451	0.43887	10.3896
488	1C4U	IH1	0.001212	0.43431	10.3896
489	4MZ7	DTP	0.003602	0.43058	10.3896
490	3MCT	SAH	0.001788	0.43047	10.3896
491	2ZJ3	G6P	0.002476	0.42283	10.3896
492	4USQ	FAD	0.007773	0.42127	10.3896
493	3GE7	AFQ	0.008267	0.41896	10.3896
494	1O0D	163	0.003433	0.41311	10.3896
495	1Z45	UPG	0.004125	0.41196	10.3896
496	2NZU	BG6	0.001436	0.41008	10.3896
497	4MZ7	DGT	0.01177	0.40879	10.3896
498	1L2T	ATP	0.01033	0.40278	10.3896
499	1Z45	NAD	0.01686	0.40214	10.3896
500	1EZV	SMA	0.009753	0.40825	10.8108
501	1GJW	GLC	0.0003256	0.46994	11.039
502	1MDZ	DCS	0.0006564	0.4661	11.039
503	1MDZ	PLP	0.0006993	0.46355	11.039
504	4M5P	MLA	0.001954	0.46155	11.039
505	2C31	TZD	0.007684	0.44854	11.039
506	2C31	ADP	0.007467	0.44854	11.039
507	4M5P	23W	0.002155	0.44144	11.039
508	1V35	NAI	0.007629	0.42889	11.039
509	2NCD	ADP	0.001549	0.42616	11.039
510	3N5O	GSH	0.002756	0.41898	11.039
511	4CMF	PXG	0.02661	0.41123	11.039
512	4AP9	1PS	0.007864	0.40257	11.039
513	1FP1	HCC	0.007264	0.4021	11.039
514	2BO4	FLC	0.00007222	0.49877	11.6883
515	1DXY	COI	0.0005801	0.47727	11.6883
516	1WVG	APR	0.0003706	0.46578	11.6883
517	1C0I	FAD	0.001868	0.45978	11.6883
518	1C0I	BE2	0.001868	0.45978	11.6883
519	1RYD	NDP	0.003179	0.44144	11.6883
520	2BLE	5GP	0.008578	0.43941	11.6883
521	3FED	BIX	0.000804	0.43818	11.6883
522	1XOC	VAL ASP SER LYS ASN THR SER SER TRP	0.004971	0.43611	11.6883
523	4W6Z	ETF	0.005291	0.43119	11.6883
524	3V1U	NAD	0.005182	0.41825	11.6883
525	3RK0	AMP	0.0006739	0.41008	11.6883
526	1RYD	GLC	0.000899	0.40427	11.6883
527	3V1U	HXC	0.003701	0.40251	11.6883
528	1QDS	PGA	0.002159	0.40102	11.6883
529	1YGC	905	0.000691	0.44516	12.3377
530	2DKH	3HB	0.008921	0.42396	12.3377
531	1T10	F6P	0.002184	0.42007	12.3377
532	2DKH	FAD	0.008285	0.41892	12.3377
533	1FS5	TLA	0.006165	0.4173	12.3377
534	1C3V	PDC	0.00054	0.41676	12.3377
535	3P7I	P7I	0.002528	0.4116	12.3377
536	4HZD	COA	0.01913	0.40542	12.3377
537	1C3V	NDP	0.01632	0.40395	12.3377
538	3F81	STT	0.001392	0.45903	12.987
539	1FBL	HTA	0.0001063	0.44727	12.987
540	1OFH	ADP	0.003338	0.42619	12.987
541	3C1O	NAP	0.001879	0.4349	13.6364
542	4AMV	F6R	0.001527	0.42485	13.6364
543	5T0A	A3P	0.00304	0.4071	13.6364
544	1F1V	DHY	0.0029	0.40386	13.6364
545	1ECM	TSA	0.0002644	0.44347	13.7615
546	4TSK	NDP	0.04708	0.40388	14.2857
547	4INB	1F6	0.004524	0.41227	14.3836
548	1I2B	UPG	0.005649	0.44486	14.9351
549	1I2B	USQ	0.005649	0.44486	14.9351
550	1I2B	NAD	0.005649	0.44486	14.9351
551	2WQP	WQP	0.002236	0.43497	14.9351
552	2TPL	HPP	0.002723	0.42986	14.9351
553	4OE4	NAD	0.00445	0.42736	14.9351
554	2O66	FLC	0.0008453	0.43691	15.5556
555	4WBD	ADP	0.0005926	0.45848	15.5844
556	4WBD	CIT	0.001412	0.44987	15.5844
557	3WE0	FAD	0.004063	0.44289	15.5844
558	3NNF	AKG	0.0013	0.43605	15.5844
559	3GEG	NAD	0.007477	0.41449	15.5844
560	4AQL	TXC	0.003928	0.41079	16.2338
561	4CKL	SM8	0.008705	0.40254	16.2338
562	3SQG	COM	0.001797	0.46338	16.8831
563	1Q3Q	ANP	0.01034	0.43431	16.8831
564	3M0J	OAF	0.004099	0.42952	16.8831
565	2NVK	NAP	0.004237	0.40274	16.8831
566	2Q97	ATP	0.001525	0.43513	17.5325
567	1OLS	TDP	0.01379	0.42017	17.5325
568	4DN8	BMA	0.00665	0.40597	17.5325
569	2OZE	AGS	0.007749	0.40097	17.5325
570	3QDY	CBS	0.001346	0.44277	18.1818
571	2R40	EPH	0.002394	0.43878	18.1818
572	3PJU	C2E	0.00238	0.43384	18.1818
573	4DQ2	BTX	0.003483	0.42983	18.1818
574	2R40	20E	0.002579	0.42923	18.1818
575	3QDY	A2G GAL	0.008305	0.41448	18.1818
576	3QDT	A2G GAL	0.009909	0.41094	18.1818
577	1R37	NAD	0.002057	0.44612	18.8312
578	3D2Y	AH0 ALA FGA LYS	0.0001235	0.40306	18.8312
579	3KMT	SAH	0.0002998	0.41187	19.3277
580	3CL7	HYN	0.004491	0.41928	19.4805
581	4EXO	PYR	0.01231	0.4066	20.5479
582	1GSA	GSH	0.001826	0.45627	20.7792
583	1GSA	ADP	0.002781	0.45388	20.7792
584	2YK7	CSF	0.007727	0.40288	24.6753
585	1G6O	ADP	0.004988	0.44732	25.3247
586	4GYW	UDP	0.005983	0.42378	25.974
587	1WNG	SAH	0.0000729	0.40609	25.974
588	2XBP	ATP	0.01109	0.42568	26.5487
589	1FIQ	FAD	0.0008814	0.46193	29.8701
590	1FIQ	MTE	0.005659	0.42227	29.8701
591	1FIQ	SAL	0.01483	0.40691	29.8701
592	1B9I	PXG	0.004279	0.41853	31.1688
593	2HGZ	PBF	0.00324	0.42514	32.4675

Pocket No.: 4; Query (leader) PDB : 3PNA; Ligand: CMP; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.

This union binding pocket(no: 4) in the query (biounit: 3pna.bio3) has 15 residues
No:	Leader PDB	Ligand	P-value (APoc)	PS_Score (APoc)	Sequence Similarity