Receptor
PDB id Resolution Class Description Source Keywords
1JAY 1.65 Å EC: 7.-.-.- STRUCTURE OF COENZYME F420H2:NADP+ OXIDOREDUCTASE (FNO) WITH SUBSTRATES BOUND ARCHAEOGLOBUS FULGIDUS ROSSMANN FOLD STRUCTURAL GENOMICS
Ref.: STRUCTURES OF F420H2:NADP+ OXIDOREDUCTASE WITH AND ITS SUBSTRATES BOUND. EMBO J. V. 20 6561 2001
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
F42 A:214;
B:214;
Valid;
Valid;
none;
none;
submit data
773.593 C29 H36 N5 O18 P C[C@@...
NA A:215;
B:1215;
Part of Protein;
Part of Protein;
none;
none;
submit data
22.99 Na [Na+]
NAP A:213;
B:213;
Valid;
Valid;
none;
none;
submit data
743.405 C21 H28 N7 O17 P3 c1cc(...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1JAY 1.65 Å EC: 7.-.-.- STRUCTURE OF COENZYME F420H2:NADP+ OXIDOREDUCTASE (FNO) WITH SUBSTRATES BOUND ARCHAEOGLOBUS FULGIDUS ROSSMANN FOLD STRUCTURAL GENOMICS
Ref.: STRUCTURES OF F420H2:NADP+ OXIDOREDUCTASE WITH AND ITS SUBSTRATES BOUND. EMBO J. V. 20 6561 2001
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 250 families.
1 1JAY - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
70% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 217 families.
1 1JAY - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
50% Homology Family (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 1JAY - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
2 5N2I - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: F42; Similar ligands found: 4
No: Ligand ECFP6 Tc MDL keys Tc
1 F42 1 1
2 6J4 1 1
3 FO1 0.508333 0.833333
4 HDF 0.508333 0.833333
Ligand no: 2; Ligand: NAP; Similar ligands found: 127
No: Ligand ECFP6 Tc MDL keys Tc
1 NAP 1 1
2 NA0 0.881356 0.986301
3 TAP 0.872881 0.934211
4 NDO 0.840336 0.972603
5 NAD 0.811966 0.986111
6 N01 0.733871 0.958904
7 A3D 0.712 0.972603
8 NBP 0.707692 0.935065
9 NAD IBO 0.688 0.921053
10 NHD 0.68254 0.958904
11 NJP 0.661417 0.972973
12 NAJ PYZ 0.659091 0.898734
13 NFD 0.658915 0.934211
14 DND 0.619048 0.959459
15 NXX 0.619048 0.959459
16 ZID 0.605839 0.972603
17 NAQ 0.59854 0.922078
18 ATR 0.59292 0.917808
19 NAE 0.591241 0.946667
20 NDE 0.58042 0.986301
21 A22 0.571429 0.958904
22 AMP NAD 0.571429 0.933333
23 NAJ 0.567164 0.986111
24 A2R 0.563025 0.932432
25 NDC 0.561644 0.922078
26 NA7 0.552846 0.907895
27 ODP 0.551471 0.935065
28 A2P 0.539823 0.930556
29 8ID 0.537313 0.910256
30 NAD BBN 0.525974 0.865854
31 NPW 0.525547 0.8875
32 CNA 0.521739 0.959459
33 NZQ 0.521739 0.910256
34 NAD CJ3 0.519231 0.835294
35 NDP 0.514493 0.922078
36 PO4 PO4 A A A A PO4 0.503937 0.930556
37 DG1 0.503401 0.922078
38 1DG 0.503401 0.922078
39 NAD TDB 0.5 0.696078
40 TXP 0.5 0.922078
41 NMN AMP PO4 0.492958 0.921053
42 XNP 0.492958 0.875
43 25L 0.492308 0.958904
44 25A 0.492063 0.972222
45 NAD NDT 0.490909 0.747368
46 NMN 0.486726 0.888889
47 NGD 0.485714 0.935065
48 2AM 0.477876 0.891892
49 ADP 0.458333 0.945205
50 PAP 0.451613 0.931507
51 ADP MG 0.45082 0.906667
52 BEF ADP 0.447154 0.883117
53 ADP BEF 0.447154 0.883117
54 A2D 0.445378 0.945205
55 AN2 0.442623 0.932432
56 ADP PO3 0.44 0.944444
57 SAP 0.44 0.896104
58 AGS 0.44 0.896104
59 M33 0.439024 0.906667
60 AR6 AR6 0.438849 0.945205
61 BA3 0.438017 0.945205
62 ATP MG 0.436508 0.906667
63 ADP BMA 0.43609 0.92
64 OAD 0.43609 0.92
65 ATP 0.435484 0.945205
66 OOB 0.435115 0.958904
67 B4P 0.434426 0.945205
68 AP5 0.434426 0.945205
69 GAP 0.433071 0.92
70 0WD 0.432432 0.922078
71 5FA 0.432 0.945205
72 2A5 0.432 0.87013
73 AQP 0.432 0.945205
74 00A 0.428571 0.909091
75 CA0 0.427419 0.92
76 ALF ADP 0.426357 0.871795
77 ADP ALF 0.426357 0.871795
78 ACP 0.424 0.92
79 NAJ PZO 0.423841 0.897436
80 9SN 0.423358 0.897436
81 VO4 ADP 0.423077 0.932432
82 ANP MG 0.423077 0.896104
83 ADP VO4 0.423077 0.932432
84 WAQ 0.422222 0.884615
85 ACQ 0.421875 0.92
86 V3L 0.421875 0.945205
87 ADQ 0.421053 0.92
88 AR6 0.420635 0.918919
89 APR 0.420635 0.918919
90 ATP A A A 0.42029 0.958333
91 CO7 0.419753 0.786517
92 1ZZ 0.419118 0.841463
93 3OD 0.419118 0.92
94 DLL 0.41791 0.958904
95 AD9 0.417323 0.92
96 NAX 0.416667 0.875
97 OVE 0.416667 0.857143
98 MYR AMP 0.416058 0.841463
99 AV2 0.415385 0.868421
100 A3P 0.414634 0.944444
101 NNR 0.414414 0.72973
102 ALF ADP 3PG 0.413793 0.8625
103 OMR 0.413793 0.831325
104 LA8 ALF 3PG 0.413793 0.8625
105 ANP 0.410853 0.92
106 A1R 0.410448 0.860759
107 ABM 0.409836 0.893333
108 AMP 0.408333 0.944444
109 A 0.408333 0.944444
110 SON 0.408 0.933333
111 PPS 0.407692 0.829268
112 5AL 0.407692 0.932432
113 TYR AMP 0.407143 0.933333
114 NAI 0.406897 0.909091
115 7D3 0.406504 0.857143
116 DAL AMP 0.406015 0.932432
117 ADX 0.404762 0.829268
118 ATF 0.40458 0.907895
119 3UK 0.404412 0.945946
120 AMP DBH 0.404255 0.894737
121 139 0.402685 0.875
122 AMP MG 0.401639 0.893333
123 50T 0.401575 0.906667
124 SRP 0.401515 0.907895
125 A A 0.40146 0.972222
126 FA5 0.4 0.933333
127 3AM 0.4 0.90411
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 1JAY; Ligand: F42; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 1) in the query (biounit: 1jay.bio1) has 13 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 1JAY; Ligand: F42; Similar sites found: 26
This union binding pocket(no: 2) in the query (biounit: 1jay.bio1) has 16 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 1UO5 PIH 0.0006069 0.48666 None
2 1FDQ HXA 0.0225 0.40677 None
3 1DR1 NAP 0.03683 0.4056 1.41509
4 1JQI FAD 0.02901 0.41006 2.83019
5 5UC9 MYR 0.01554 0.40491 2.83019
6 3WMX THR 0.02212 0.40353 2.83019
7 4U0I 0LI 0.03249 0.40109 2.83019
8 4V24 GYR 0.03357 0.4015 3.77358
9 2J83 BAT 0.01821 0.401 3.77358
10 2Q8H TF4 0.02033 0.41008 4.24528
11 2WOX NDP 0.0317 0.40604 4.24528
12 2FWP ICR 0.009116 0.40774 4.37158
13 4WGF HX2 0.01874 0.40512 4.39024
14 1QJC PNS 0.01779 0.41901 4.43038
15 4PNE SAH 0.02246 0.40129 4.71698
16 4MGA 27L 0.01876 0.40947 5.18868
17 3KP6 SAL 0.02321 0.40912 5.66038
18 1VHT BA3 0.01202 0.40203 6.60377
19 1XZ3 ICF 0.01325 0.4295 7.47126
20 2HMT NAI 0.01394 0.41001 8.01887
21 1D8C SOR 0.02954 0.40788 8.49057
22 4DP3 MMV 0.04668 0.40615 10.3774
23 1ZOY UQ1 0.01076 0.41199 10.8491
24 2ZE7 AMP 0.01338 0.41396 11.4625
25 4XDZ 40E 0.00356 0.43848 12.2642
26 1L0I PSR 0.003548 0.43342 28.2051
Pocket No.: 3; Query (leader) PDB : 1JAY; Ligand: NAP; Similar sites found: 435
This union binding pocket(no: 3) in the query (biounit: 1jay.bio1) has 24 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 1I36 NAP 0.00001553 0.50747 None
2 1DRV A3D 0.0005506 0.44152 None
3 3JUC PCA 0.0135 0.42439 None
4 4TSK NDP 0.0000105 0.52088 1.41509
5 2VO4 4NM 0.02493 0.41264 1.41509
6 2Y6Q I7T 0.02133 0.40112 1.41509
7 2Y6Q FAD 0.01067 0.40095 1.41509
8 4ZGS NAD 0.0004364 0.44943 1.88679
9 2DFV NAD 0.001758 0.42903 1.88679
10 4UP3 NDP 0.002607 0.41374 1.88679
11 3TN7 NJP 0.006515 0.40894 1.88679
12 2B9W FAD 0.02365 0.4049 1.88679
13 5EB4 FAD 0.01703 0.40129 1.88679
14 2DT5 NAD 0.000003724 0.48724 1.89573
15 4W6Z 8ID 0.0002023 0.48058 2.35849
16 4K28 NAD 0.0000324 0.4716 2.35849
17 1E5Q NDP 0.0001734 0.42696 2.35849
18 1CER NAD 0.0003834 0.4241 2.35849
19 2Q46 NAP 0.003434 0.41816 2.35849
20 2X6T NAP 0.005207 0.41182 2.35849
21 4J36 1HR 0.01201 0.40987 2.35849
22 4J36 FAD 0.00733 0.40917 2.35849
23 1EQ2 NAP 0.006243 0.40846 2.35849
24 1LCF OXL 0.03682 0.40622 2.35849
25 4U7W NDP 0.001015 0.40411 2.35849
26 1V6A TRE 0.02285 0.40836 2.40964
27 3H9E NAD 0.0007497 0.41495 2.60116
28 2GZ3 NAP 0.00003774 0.5273 2.83019
29 3WBF NAP 0.000002489 0.48909 2.83019
30 1DXY NAD 0.0001316 0.47478 2.83019
31 1SAY PYR 0.000323 0.46907 2.83019
32 2YVF FAD 0.001842 0.45902 2.83019
33 2YVF NAD 0.00191 0.45902 2.83019
34 3WBF API 0.000003884 0.45792 2.83019
35 4GKV NAD 0.0005991 0.45746 2.83019
36 3BAZ NAP 0.0001126 0.45093 2.83019
37 1R37 NAD 0.0009607 0.44858 2.83019
38 2C7G FAD 0.004765 0.43701 2.83019
39 2C7G ODP 0.004588 0.43701 2.83019
40 2DC1 NAD 0.001182 0.4363 2.83019
41 1RM4 NDP 0.001288 0.43474 2.83019
42 3WMX NAD 0.0006185 0.41805 2.83019
43 3F8D FAD 0.02947 0.4082 2.83019
44 3QVP FAD 0.01395 0.40695 2.83019
45 1EZ0 NAP 0.006975 0.4064 2.83019
46 1NVT NAP 0.000006855 0.5244 3.30189
47 1V8B NAD 0.0001313 0.48878 3.30189
48 3CGD COA 0.0008308 0.48533 3.30189
49 3CGD NAD 0.0008308 0.48533 3.30189
50 3CGD FAD 0.0008308 0.48533 3.30189
51 2NAD NAD 0.0002053 0.47896 3.30189
52 2EV9 NAP 0.0001838 0.47677 3.30189
53 2B4R NAD 0.0003585 0.46285 3.30189
54 9LDT NAD 0.0003732 0.4621 3.30189
55 1U1I NAD 0.0005258 0.45991 3.30189
56 3CMC NAD 0.002425 0.45697 3.30189
57 1KYQ NAD 0.0001306 0.44559 3.30189
58 2B4R AES 0.001211 0.43882 3.30189
59 2V6G NAP 0.001888 0.43199 3.30189
60 1PJS NAD 0.000566 0.42607 3.30189
61 1I2B NAD 0.008404 0.42494 3.30189
62 4OPC PGT 0.03823 0.41513 3.30189
63 2EV9 SKM 0.0001838 0.4129 3.30189
64 1O0S NAI 0.002057 0.41287 3.30189
65 4OPC FDA 0.03814 0.41247 3.30189
66 9LDB NAD 0.0003053 0.41241 3.30189
67 2BRY FAD 0.006407 0.4117 3.30189
68 2DTX BMA 0.01091 0.40803 3.30189
69 3H8V ATP 0.0021 0.40621 3.30189
70 2GVC FAD 0.009828 0.40366 3.30189
71 2YVJ NAI 0.001624 0.43327 3.66972
72 5UAV NDP 0.0000004549 0.59602 3.77358
73 5UAV TFB 0.0000004549 0.59602 3.77358
74 4YCA NDP 0.000001206 0.51525 3.77358
75 2AG8 NAP 0.00001519 0.50028 3.77358
76 4KP7 NAP 0.0003955 0.4802 3.77358
77 4KP7 1UQ 0.0003583 0.478 3.77358
78 2QRK AMP 0.0003515 0.47263 3.77358
79 1U3U BNF 0.0007839 0.46178 3.77358
80 1LJ8 NAD 0.0003013 0.45228 3.77358
81 4XB2 HSE 0.000716 0.45141 3.77358
82 4XB2 NDP 0.0003669 0.4507 3.77358
83 2GLX NDP 0.0006025 0.44361 3.77358
84 2VT3 ATP 0.00005301 0.44266 3.77358
85 1CDO NAD 0.0008013 0.44183 3.77358
86 1HYE NAP 0.0007036 0.43901 3.77358
87 1M2W NAD 0.0007054 0.43225 3.77358
88 5VKT NAP 0.0001059 0.42983 3.77358
89 3SQP FAD 0.03528 0.42968 3.77358
90 4D04 NAP 0.009659 0.42695 3.77358
91 1BXK NAD 0.002252 0.42594 3.77358
92 3UOY NAP 0.01159 0.42572 3.77358
93 4MIG G3F 0.00742 0.42354 3.77358
94 1LDM NAD 0.0002158 0.42219 3.77358
95 3JYN NDP 0.004149 0.41986 3.77358
96 1TB4 PEJ 0.0002878 0.41654 3.77358
97 1X7D ORN 0.00804 0.41186 3.77358
98 2HQM FAD 0.01077 0.4111 3.77358
99 1X7D NAD 0.005387 0.40985 3.77358
100 5MDH NAD 0.005245 0.40896 3.77358
101 3NT6 FAD 0.01096 0.40695 3.77358
102 3AJ6 NGA 0.02356 0.40625 3.77358
103 2WSB NAD 0.01441 0.40362 3.77358
104 3GGO ENO 0.00001336 0.5391 4.24528
105 3GGO NAI 0.00001336 0.5391 4.24528
106 2G5C NAD 0.00002106 0.51375 4.24528
107 4E5N NAD 0.00003533 0.50588 4.24528
108 1SC6 NAD 0.00005584 0.49899 4.24528
109 4XDY NAI 0.000004846 0.49445 4.24528
110 3A06 NDP 0.0001644 0.48176 4.24528
111 3A06 FOM 0.0001901 0.48176 4.24528
112 2FZW NAD 0.0003467 0.47863 4.24528
113 1EBF NAD 0.0001744 0.46599 4.24528
114 1LDN NAD 0.0005629 0.45447 4.24528
115 2YY7 NAD 0.0005898 0.4536 4.24528
116 1BXG NAD 0.001006 0.43768 4.24528
117 3ORF NAD 0.001359 0.43524 4.24528
118 1M0S CIT 0.007206 0.42864 4.24528
119 3RNM FAD 0.004831 0.42758 4.24528
120 1MO9 KPC 0.01494 0.42649 4.24528
121 1BZL FAD 0.02321 0.42271 4.24528
122 1MO9 FAD 0.01826 0.42179 4.24528
123 1J5P NAD 0.0004761 0.42092 4.24528
124 1HYH NAD 0.0002545 0.41398 4.24528
125 3L9W AMP 0.00577 0.41121 4.24528
126 1ZMD NAI 0.001766 0.40989 4.24528
127 5DOZ NDP 0.0004284 0.40746 4.24528
128 3NTD FAD 0.01116 0.4066 4.24528
129 1C1X NAD 0.001653 0.40362 4.24528
130 2IXB NAD 0.0004561 0.4025 4.24528
131 2YYY NAP 0.0002261 0.46827 4.71698
132 1D4D FAD 0.004622 0.42844 4.71698
133 1V59 FAD 0.006409 0.42388 4.71698
134 1PL6 572 0.003362 0.42255 4.71698
135 3WV8 ATP 0.00279 0.41935 4.71698
136 1PL6 NAD 0.001768 0.41736 4.71698
137 1K3T BRZ 0.005131 0.41587 4.71698
138 1C3V NDP 0.0002989 0.412 4.71698
139 3S5W FAD 0.007281 0.40687 4.71698
140 1U7T NAD 0.006334 0.4055 4.71698
141 1U7T TDT 0.01373 0.40547 4.71698
142 1WVG APR 0.005427 0.40543 4.71698
143 4B7X NAP 0.0003002 0.40141 4.71698
144 5L95 AMP 0.004318 0.41122 5
145 4KQW NAP 0.000002969 0.5572 5.18868
146 5M67 ADE 0.0004825 0.47727 5.18868
147 5M67 3D1 0.0005105 0.47616 5.18868
148 5M67 NAD 0.0005177 0.47589 5.18868
149 4BVA NDP 0.0007195 0.44991 5.18868
150 2RAB NAD 0.005681 0.43965 5.18868
151 3MJE NDP 0.001241 0.43837 5.18868
152 1KEW TYD 0.005319 0.43092 5.18868
153 1WMA AB3 0.004421 0.4293 5.18868
154 1KEW NAD 0.006144 0.42888 5.18868
155 4BVA T3 0.003934 0.42656 5.18868
156 4OOE NDP 0.0004028 0.42375 5.18868
157 1R6D NAD 0.009001 0.42283 5.18868
158 1E7S NAP 0.003325 0.42276 5.18868
159 2RAB FAD 0.007123 0.42094 5.18868
160 1R6D DAU 0.009591 0.42082 5.18868
161 2V3A FAD 0.00555 0.41998 5.18868
162 1GQ2 NAP 0.0004478 0.41344 5.18868
163 1PS9 FAD 0.009941 0.41173 5.18868
164 1PS9 NAP 0.005592 0.40636 5.18868
165 3LXD FAD 0.01016 0.40527 5.18868
166 4EUE NAI 0.0109 0.40055 5.18868
167 4JK3 NAD 0.00000982 0.52211 5.66038
168 4J4H NAI 0.0000461 0.52118 5.66038
169 4J4H 1J1 0.0000461 0.52118 5.66038
170 1ZH8 NAP 0.0002031 0.46858 5.66038
171 1DSS NAD 0.0002561 0.46088 5.66038
172 1PGP 6PG 0.0008056 0.45442 5.66038
173 1KOL NAD 0.001078 0.44891 5.66038
174 2WPF FAD 0.009706 0.44079 5.66038
175 1RP0 AHZ 0.001391 0.43903 5.66038
176 2WPF WPF 0.01183 0.43793 5.66038
177 1N7G GDR 0.004559 0.43789 5.66038
178 1N7G NDP 0.008053 0.43437 5.66038
179 4R5M NAP 0.0001211 0.43137 5.66038
180 3Q3C NAD 0.001189 0.43134 5.66038
181 4R5M 4NO 0.0001442 0.41879 5.66038
182 1HKU NAD 0.0001973 0.4152 5.66038
183 1F8F NAD 0.0033 0.41447 5.66038
184 2DKH FAD 0.005871 0.41334 5.66038
185 4D79 ATP 0.004919 0.41222 5.66038
186 3Q9T FAY 0.009195 0.41032 5.66038
187 1B8U OAA 0.006964 0.40894 5.66038
188 1B8U NAD 0.002902 0.40795 5.66038
189 5DN9 NAD 0.0001706 0.40755 5.66038
190 2DKH 3HB 0.01223 0.40584 5.66038
191 1LLU NAD 0.0002763 0.40265 5.66038
192 1LVL NAD 0.006156 0.40143 5.66038
193 4RDH AMP 0.01232 0.40133 5.66038
194 3GD4 NAD 0.009645 0.43294 5.67515
195 3GD4 FAD 0.01227 0.41947 5.67515
196 1GR0 NAD 0.00002592 0.51648 6.13208
197 1VI2 NAD 0.0001359 0.46649 6.13208
198 3CTY FAD 0.00075 0.46472 6.13208
199 1SOW NAD 0.0004993 0.45813 6.13208
200 3WLE NAD 0.001442 0.44339 6.13208
201 1NPD NAD 0.0003237 0.43903 6.13208
202 5JCM FAD 0.005532 0.4389 6.13208
203 5JCM ISD 0.005712 0.4389 6.13208
204 5JCM NAD 0.00588 0.43831 6.13208
205 3RFV NAI 0.00242 0.42316 6.13208
206 3DAG FEG 0.002344 0.42069 6.13208
207 5DP2 NAP 0.00316 0.41827 6.13208
208 2CVQ NDP 0.0003727 0.41636 6.13208
209 1FEC FAD 0.01052 0.41503 6.13208
210 3RFV 15L 0.005264 0.40747 6.13208
211 5ITV NAI 0.007374 0.40664 6.13208
212 2Q2V NAD 0.01064 0.40217 6.13208
213 1E6E FAD 0.002482 0.4331 6.25
214 2BH9 NAP 0.0000009981 0.58809 6.60377
215 1YS4 NAP 0.00005143 0.48384 6.60377
216 3CIF NAD 0.0001404 0.47704 6.60377
217 1VL0 NAI 0.0003068 0.4576 6.60377
218 1YY5 FAD 0.001121 0.45691 6.60377
219 1WP4 NDP 0.00004251 0.45627 6.60377
220 4PLG NAI 0.0008879 0.45378 6.60377
221 3T31 DCQ 0.00222 0.45303 6.60377
222 3T31 FAD 0.002052 0.45303 6.60377
223 3CIF G3H 0.001589 0.44035 6.60377
224 4RPL 3UC 0.006636 0.43711 6.60377
225 2CVZ NDP 0.0002304 0.43661 6.60377
226 4RPL FAD 0.007083 0.43389 6.60377
227 1GET NAP 0.008554 0.43253 6.60377
228 1GET FAD 0.008665 0.43105 6.60377
229 2NVK FAD 0.004238 0.4282 6.60377
230 5AOG IAC 0.0386 0.41833 6.60377
231 1GY8 NAD 0.005278 0.41287 6.60377
232 1DIG NAP 0.00712 0.40852 6.60377
233 1DIG L37 0.007766 0.40809 6.60377
234 4NTC FAD 0.01776 0.40048 6.60377
235 1YJQ NAP 0.0000003966 0.59316 7.07547
236 5BSH PRO 0.00004206 0.50427 7.07547
237 1YB5 NAP 0.001617 0.43879 7.07547
238 1EK6 UPG 0.005646 0.43362 7.07547
239 5IN4 6CK 0.03297 0.43068 7.07547
240 5IN4 NAP 0.03336 0.43068 7.07547
241 5IN4 GDP 0.03248 0.43047 7.07547
242 4BV6 FAD 0.004534 0.4269 7.07547
243 2E5V FAD 0.005873 0.42379 7.07547
244 4CNK FAD 0.007649 0.41384 7.07547
245 1TDF NAP 0.03698 0.40348 7.07547
246 1FL2 FAD 0.01388 0.40339 7.07547
247 1TDF FAD 0.0193 0.40309 7.07547
248 1H2B NAJ 0.0003194 0.40102 7.07547
249 1JNR FAD 0.02421 0.41387 7.33333
250 2NU8 COA 0.000001479 0.55663 7.54717
251 2VHW NAI 0.0002431 0.47711 7.54717
252 2QZZ NAP 0.000323 0.473 7.54717
253 2QZZ EMF 0.0003448 0.473 7.54717
254 4DPL NAP 0.000007249 0.47138 7.54717
255 1MUU NAD 0.0001592 0.44603 7.54717
256 2PZM NAD 0.002408 0.44108 7.54717
257 2PZM UDP 0.002408 0.44108 7.54717
258 5L4L NAP 0.002156 0.42058 7.54717
259 3TWO NDP 0.00004547 0.41999 7.54717
260 4GLL NAD 0.004662 0.41644 7.54717
261 3L4S 3PG 0.005487 0.41461 7.54717
262 3L4S NAD 0.005142 0.41461 7.54717
263 1XHC FAD 0.006842 0.41386 7.54717
264 1I0Z NAI 0.0004025 0.41344 7.54717
265 4JJF FE9 0.001337 0.40241 7.54717
266 5X20 NAD 0.00004106 0.49409 8.01887
267 1H9A NAP 0.0001453 0.48409 8.01887
268 1MV8 NAD 0.000099 0.47997 8.01887
269 1T26 NAI 0.0004064 0.47447 8.01887
270 2VYN NAD 0.0002106 0.46957 8.01887
271 1QMG APX 0.0001998 0.45327 8.01887
272 1REO FAD 0.001072 0.45249 8.01887
273 2I3G NAP 0.00001808 0.44887 8.01887
274 4MP8 NAD 0.001391 0.44525 8.01887
275 4QED NAP 0.001379 0.43642 8.01887
276 3V1Y NAD 0.0003274 0.42793 8.01887
277 2CDU FAD 0.005212 0.41903 8.01887
278 1GAD NAD 0.003063 0.41736 8.01887
279 2CDU ADP 0.0007976 0.41701 8.01887
280 2HMT NAI 0.002707 0.41307 8.01887
281 4J7U YTZ 0.01362 0.40653 8.01887
282 4J7U NAP 0.01362 0.40653 8.01887
283 4TM3 FAD 0.03422 0.40401 8.01887
284 1D1T NAD 0.0004009 0.40345 8.01887
285 4USQ FAD 0.0109 0.40284 8.01887
286 4D3F NAP 0.00001068 0.51189 8.49057
287 2CDC NAP 0.0003719 0.49431 8.49057
288 2CDC XYS 0.0003719 0.49431 8.49057
289 2CDC XYP 0.0003937 0.49315 8.49057
290 1OMO NAD 0.0000595 0.4854 8.49057
291 2C29 NAP 0.0004899 0.47194 8.49057
292 1NYT NAP 0.0000539 0.46303 8.49057
293 3KB6 NAD 0.000333 0.45952 8.49057
294 2C29 DQH 0.001803 0.44669 8.49057
295 5U5G NAP 0.00008078 0.44168 8.49057
296 5L4S 6KX 0.00258 0.4335 8.49057
297 5L4S NAP 0.00258 0.4335 8.49057
298 1VM6 NAD 0.002128 0.42244 8.49057
299 1DJN ADP 0.003509 0.41014 8.49057
300 4EIP K2C 0.01907 0.40332 8.49057
301 3LAD FAD 0.01861 0.40046 8.49057
302 1P77 ATR 0.0003323 0.50242 8.96226
303 2O4C NAD 0.0001236 0.48263 8.96226
304 4RQU NAD 0.0003537 0.46003 8.96226
305 3UCL NAP 0.01575 0.42002 8.96226
306 3UCL FAD 0.01552 0.41855 8.96226
307 3UCL CYH 0.01552 0.41855 8.96226
308 1O8B ABF 0.01289 0.4159 8.96226
309 3KO8 NAD 0.004802 0.41589 8.96226
310 5LD5 NAD 0.002697 0.40831 8.96226
311 3KLJ FAD 0.007987 0.40756 8.96226
312 3ICR FAD 0.01109 0.40571 8.96226
313 3ICS FAD 0.01271 0.40411 8.96226
314 3ICT ADP 0.0006536 0.40347 8.96226
315 1O94 ADP 0.002797 0.40276 8.96226
316 3GMB FAD 0.01138 0.40202 8.96226
317 3ETG GTP 0.02048 0.4003 8.96226
318 3ICT FAD 0.01493 0.40003 8.96226
319 1A5Z NAD 0.003456 0.4087 9.09091
320 1NVM NAD 0.0001224 0.42493 9.27536
321 2F5Z FAD 0.004637 0.42838 9.375
322 2IZ1 ATR 0.00006141 0.54029 9.43396
323 2HK9 NAP 0.00003761 0.49762 9.43396
324 1WDK NAD 0.00003566 0.49255 9.43396
325 2GSD NAD 0.0002852 0.47276 9.43396
326 1P0F NAP 0.0005292 0.45705 9.43396
327 4EDF UPG 0.0018 0.45051 9.43396
328 2HK9 ATR 0.00007255 0.43556 9.43396
329 2XVE FAD 0.01741 0.41372 9.43396
330 2XVF FAD 0.007365 0.41353 9.43396
331 3QV1 NAD 0.0005307 0.42536 9.7561
332 5AYV NAP 0.00000872 0.51783 9.90566
333 1F06 NDP 0.00003267 0.51213 9.90566
334 1F06 2NP 0.00003267 0.51213 9.90566
335 5AYV KPL 0.00005242 0.50472 9.90566
336 1CF2 NAP 0.00004042 0.49631 9.90566
337 1WPQ NAD 0.00003287 0.49401 9.90566
338 1LTH NAD 0.000275 0.45777 9.90566
339 2Q1S NAI 0.001648 0.44843 9.90566
340 1SB8 UD2 0.007582 0.42549 9.90566
341 1SB8 NAD 0.006445 0.42549 9.90566
342 3U4C NDP 0.005558 0.40928 9.90566
343 3OA2 NAD 0.0005198 0.40891 9.90566
344 5THQ NDP 0.007089 0.4061 9.90566
345 2BKA NDP 0.00079 0.44523 10.3774
346 4KOA NDP 0.00109 0.44505 10.3774
347 1QO8 FAD 0.00772 0.41756 10.3774
348 3C7A NAD 0.0004974 0.41142 10.3774
349 4D42 W0I 0.02225 0.40258 10.3774
350 4D42 NAP 0.02225 0.40258 10.3774
351 1RSG FAD 0.0008382 0.46049 10.8491
352 3ABI NAD 0.00007065 0.43693 10.8491
353 1ZEM NAD 0.002631 0.42014 10.8491
354 5GT9 NAP 0.009245 0.40242 10.8491
355 4E13 NAD 0.000003902 0.52438 11.3208
356 1LUA NAP 0.00002956 0.48861 11.3208
357 5GZ6 NDP 0.00007833 0.48094 11.3208
358 5GZ6 7C3 0.0001157 0.46252 11.3208
359 1H82 GZZ 0.002615 0.45269 11.3208
360 2A92 NAI 0.001277 0.44062 11.3208
361 1H82 FAD 0.007746 0.42802 11.3208
362 1Y1P NMN AMP PO4 0.002771 0.40809 11.3208
363 4CQM NAP 0.006651 0.40728 11.3208
364 5MX4 HPA 0.02358 0.40236 11.3208
365 5T9E NAP 0.00001398 0.51566 11.7925
366 2AHR NAP 0.00005704 0.4383 11.7925
367 1EDO NAP 0.01094 0.40048 11.7925
368 4XDZ NDP 0.000004575 0.5033 12.2642
369 5E4R NAP 0.000001997 0.49546 12.2642
370 1J49 NAD 0.0001106 0.48142 12.2642
371 4JBI NDP 0.00003007 0.47284 12.2642
372 2F1K NAP 0.00002806 0.46961 12.2642
373 5T9F TYR 0.00001232 0.43197 12.2642
374 5T9F NAP 0.00001768 0.43189 12.2642
375 4R1S NAP 0.001091 0.40851 12.2642
376 2Q0L NAP 0.001499 0.44316 12.7358
377 4TQG NDP 0.001389 0.43485 12.7358
378 3IHG FAD 0.008083 0.40493 12.7358
379 1J0X NAD 0.0006992 0.46505 13.2075
380 2HJR APR 0.0001394 0.45967 13.2075
381 2VVM FAD 0.001499 0.44716 13.2075
382 4J1Q NDP 0.002428 0.4231 13.2075
383 2JL1 NAP 0.002696 0.41314 13.2075
384 1YQD NAP 0.0001005 0.41743 13.6792
385 2AE2 NAP 0.009751 0.41116 13.6792
386 3ITJ CIT 0.001782 0.47934 14.1509
387 4HXY NDP 0.0005846 0.45377 14.1509
388 2BGM NAJ 0.001005 0.4377 14.1509
389 4PIV NDP 0.001724 0.43368 14.1509
390 1LSS NAD 0.003425 0.40514 14.1509
391 2DBZ NAP 0.0001384 0.4773 14.6226
392 4FWE FAD 0.0008658 0.46091 14.6226
393 4GUT FAD 0.001034 0.46043 14.6226
394 1I8T FAD 0.002322 0.4377 14.6226
395 1AE1 NAP 0.008537 0.40631 15.0943
396 5CAE COA 0.000002076 0.52359 15.566
397 5JE8 NAD 0.00001206 0.48836 15.566
398 5CAE SIN 0.000002148 0.46858 15.566
399 1ORR NAD 0.002731 0.42769 15.566
400 1GV0 NAD 0.0001606 0.47619 16.0377
401 1GUZ NAD 0.0002812 0.46426 16.0377
402 3FWN ATR 0.0009621 0.44855 16.0377
403 2GAG NAD 0.009738 0.4082 16.1616
404 2GAG FOA 0.01475 0.40756 16.1616
405 2GAG FAD 0.01515 0.40704 16.1616
406 1H6C NDP 0.0001613 0.48619 16.5094
407 1H6C SIN 0.0002875 0.47768 16.5094
408 2EXX NAP 0.000894 0.44993 16.5094
409 3B20 NAD 0.0009938 0.43457 16.5094
410 2D2I NAP 0.001919 0.42268 16.5094
411 1YKJ FAD 0.00366 0.44659 17.4528
412 3OJO NAD 0.00005747 0.48398 17.9245
413 1UXG NAD 0.0001842 0.48495 18.3962
414 2PV7 NAD 0.0000003069 0.53084 18.8679
415 2PK3 A2R 0.001329 0.4183 19.3396
416 1EZ4 NAD 0.0004646 0.42447 19.8113
417 3ULK NDP 0.00001607 0.5046 20.7547
418 3AD8 NAD 0.009677 0.40509 20.7547
419 3AD8 FAD 0.03171 0.40447 20.7547
420 3B1F NAD 0.000005694 0.52312 21.2264
421 3NJ4 NAD 0.0008689 0.49982 23.1132
422 3NJ4 AFX 0.0009124 0.49877 23.1132
423 4J56 FAD 0.01704 0.4039 23.1132
424 3B1J NAD 0.000584 0.40578 24
425 4L8V NAP 0.0007473 0.44776 24.5283
426 1Z82 NDP 0.00004032 0.45704 25
427 5MSO NAP 0.0005371 0.44913 25
428 4IDC 1XX 0.0003488 0.46625 25.4717
429 4IDC NDP 0.0003488 0.46625 25.4717
430 3KPE TM3 0.01191 0.42574 25.641
431 1N1G BCP 0.0001692 0.48262 25.9434
432 4PVD NDP 0.005199 0.40769 26.4151
433 3O26 NDP 0.002104 0.4286 28.3019
434 1O6Z NAD 0.0002223 0.46161 32.3432
435 5KKA 6V0 0.00005837 0.42748 39.1509
Pocket No.: 4; Query (leader) PDB : 1JAY; Ligand: NAP; 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: 1jay.bio1) has 24 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
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