Receptor
PDB id Resolution Class Description Source Keywords
5FA6 2.3 Å EC: 1.6.2.4 WILD TYPE HUMAN CYPOR HOMO SAPIENS CYPOR CYTOCHROME P450 REDUCTASE FLAVOPROTEIN ABS-LIKE PHEOXIDOREDUCTASE
Ref.: INSTABILITY OF THE HUMAN CYTOCHROME P450 REDUCTASE VARIANT IS THE MAJOR CONTRIBUTOR TO ITS ANTLEY-BIXL SYNDROME-LIKE PHENOTYPE. J.BIOL.CHEM. V. 291 20487 2016
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
FMN A:701;
B:701;
Valid;
Valid;
none;
none;
submit data
456.344 C17 H21 N4 O9 P Cc1cc...
NAP B:703;
A:703;
Valid;
Valid;
Atoms found LESS than expected: % Diff = 0.354;
Atoms found LESS than expected: % Diff = 0.354;
Ki = 16.1 uM
743.405 C21 H28 N7 O17 P3 c1cc(...
FAD B:702;
A:702;
Valid;
Valid;
none;
none;
submit data
785.55 C27 H33 N9 O15 P2 Cc1cc...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
5FA6 2.3 Å EC: 1.6.2.4 WILD TYPE HUMAN CYPOR HOMO SAPIENS CYPOR CYTOCHROME P450 REDUCTASE FLAVOPROTEIN ABS-LIKE PHEOXIDOREDUCTASE
Ref.: INSTABILITY OF THE HUMAN CYTOCHROME P450 REDUCTASE VARIANT IS THE MAJOR CONTRIBUTOR TO ITS ANTLEY-BIXL SYNDROME-LIKE PHENOTYPE. J.BIOL.CHEM. V. 291 20487 2016
Members (16)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 5 families.
1 3QFC - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
2 4YAF - 2AM C10 H14 N5 O7 P c1nc(c2c(n....
3 3OJX - FMN C17 H21 N4 O9 P Cc1cc2c(cc....
4 4Y9U - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
5 4Y9R - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
6 4YAL - 2AM C10 H14 N5 O7 P c1nc(c2c(n....
7 4YAW - 2AM C10 H14 N5 O7 P c1nc(c2c(n....
8 3OJW - FMN C17 H21 N4 O9 P Cc1cc2c(cc....
9 5FA6 Ki = 16.1 uM NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
10 4YAO - 2AM C10 H14 N5 O7 P c1nc(c2c(n....
11 4YAU - 2AM C10 H14 N5 O7 P c1nc(c2c(n....
12 4Y7C - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
13 3QFR - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
14 5EMN - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
15 1JA1 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
16 3QE2 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
70% Homology Family (19)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 3 families.
1 3QFC - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
2 4YAF - 2AM C10 H14 N5 O7 P c1nc(c2c(n....
3 3OJX - FMN C17 H21 N4 O9 P Cc1cc2c(cc....
4 4Y9U - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
5 4Y9R - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
6 4YAL - 2AM C10 H14 N5 O7 P c1nc(c2c(n....
7 4YAW - 2AM C10 H14 N5 O7 P c1nc(c2c(n....
8 3OJW - FMN C17 H21 N4 O9 P Cc1cc2c(cc....
9 5FA6 Ki = 16.1 uM NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
10 4YAO - 2AM C10 H14 N5 O7 P c1nc(c2c(n....
11 4YAU - 2AM C10 H14 N5 O7 P c1nc(c2c(n....
12 4Y7C - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
13 3QFR - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
14 5EMN - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
15 1JA1 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
16 3QE2 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
17 3FJO - FMN C17 H21 N4 O9 P Cc1cc2c(cc....
18 3QFT - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
19 3QFS - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
50% Homology Family (20)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 3QFC - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
2 4YAF - 2AM C10 H14 N5 O7 P c1nc(c2c(n....
3 3OJX - FMN C17 H21 N4 O9 P Cc1cc2c(cc....
4 4Y9U - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
5 4Y9R - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
6 4YAL - 2AM C10 H14 N5 O7 P c1nc(c2c(n....
7 4YAW - 2AM C10 H14 N5 O7 P c1nc(c2c(n....
8 3OJW - FMN C17 H21 N4 O9 P Cc1cc2c(cc....
9 5FA6 Ki = 16.1 uM NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
10 4YAO - 2AM C10 H14 N5 O7 P c1nc(c2c(n....
11 4YAU - 2AM C10 H14 N5 O7 P c1nc(c2c(n....
12 4Y7C - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
13 3QFR - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
14 5EMN - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
15 1JA1 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
16 3QE2 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
17 3FJO - FMN C17 H21 N4 O9 P Cc1cc2c(cc....
18 3QFT - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
19 3QFS - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
20 5GXU - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: FMN; Similar ligands found: 16
No: Ligand ECFP6 Tc MDL keys Tc
1 FMN 1 1
2 RBF 0.75641 0.876712
3 RS3 0.571429 0.831169
4 FAS 0.543307 0.876543
5 FAD 0.543307 0.876543
6 FAE 0.539062 0.865854
7 DAL FAD PER 0.5 0.833333
8 LFN 0.475 0.643836
9 C3F 0.473684 0.74359
10 CF4 0.463918 0.734177
11 FAY 0.446043 0.864198
12 FNR 0.444444 0.909091
13 RFL 0.442857 0.845238
14 4LS 0.411215 0.875
15 1VY 0.406593 0.769231
16 DLZ 0.404494 0.782051
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
Ligand no: 3; Ligand: FAD; Similar ligands found: 119
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 6FA 0.794118 0.987654
6 DAL FAD PER 0.772414 0.951807
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 62F 0.572327 0.939024
12 F2N 0.566265 0.886364
13 FMN 0.543307 0.876543
14 FA9 0.526316 0.939759
15 6YU 0.516304 0.860215
16 CNV FAD 0.511905 0.908046
17 P6G FDA 0.511628 0.908046
18 FAD NBT 0.508876 0.83871
19 A2D 0.504065 0.875
20 P5F 0.491329 0.941176
21 FAD CNX 0.488506 0.8125
22 APR 0.488372 0.851852
23 AR6 0.488372 0.851852
24 AGS 0.484615 0.811765
25 SAP 0.484615 0.811765
26 M33 0.484375 0.864198
27 BA3 0.484127 0.875
28 FAD NBA 0.480663 0.802083
29 ATP 0.48062 0.851852
30 B4P 0.480315 0.875
31 ADP 0.480315 0.851852
32 AP5 0.480315 0.875
33 ANP 0.477273 0.831325
34 AQP 0.476923 0.851852
35 5FA 0.476923 0.851852
36 48N 0.469388 0.902439
37 OAD 0.467626 0.876543
38 GTA 0.465753 0.892857
39 AN2 0.465116 0.841463
40 AD9 0.462121 0.831325
41 3OD 0.460993 0.876543
42 RBF 0.460938 0.790123
43 FB0 0.460606 0.835165
44 139 0.460526 0.858824
45 AP0 0.46 0.835294
46 A22 0.459854 0.864198
47 ACP 0.458015 0.853659
48 8QN 0.456522 0.864198
49 PRX 0.454545 0.831325
50 A1R 0.453237 0.86747
51 G3A 0.452055 0.902439
52 T5A 0.45098 0.872093
53 G5P 0.44898 0.902439
54 ATF 0.448529 0.821429
55 50T 0.44697 0.819277
56 ACQ 0.444444 0.853659
57 PAJ 0.442857 0.847059
58 ADQ 0.442857 0.853659
59 5AL 0.441176 0.864198
60 ADX 0.439394 0.775281
61 CA0 0.439394 0.853659
62 A4P 0.437909 0.831461
63 25L 0.4375 0.864198
64 P33 FDA 0.436464 0.817204
65 5SV 0.435714 0.793103
66 TXE 0.434211 0.890244
67 OMR 0.434211 0.818182
68 ABM 0.434109 0.829268
69 A 0.433071 0.82716
70 AMP 0.433071 0.82716
71 4AD 0.432624 0.855422
72 ADJ 0.432258 0.818182
73 BIS 0.430556 0.802326
74 SRA 0.429688 0.788235
75 AFH 0.42953 0.825581
76 TXD 0.427632 0.890244
77 NXX 0.427632 0.865854
78 UP5 0.427632 0.878049
79 DND 0.427632 0.865854
80 6V0 0.427632 0.857143
81 SRP 0.42446 0.843373
82 PR8 0.423611 0.837209
83 TAT 0.423358 0.821429
84 AMO 0.422535 0.865854
85 PTJ 0.42069 0.835294
86 FYA 0.42069 0.864198
87 TXA 0.42069 0.865854
88 CNA 0.420382 0.865854
89 00A 0.41958 0.823529
90 AHX 0.41958 0.835294
91 MAP 0.41844 0.811765
92 NAI 0.418301 0.845238
93 AU1 0.41791 0.831325
94 AP2 0.416667 0.843373
95 A12 0.416667 0.843373
96 25A 0.415493 0.851852
97 AMP MG 0.415385 0.785714
98 COD 0.415094 0.842697
99 ADP BEF 0.414815 0.77907
100 BEF ADP 0.414815 0.77907
101 4TC 0.412903 0.879518
102 APC 0.411765 0.843373
103 NB8 0.410959 0.835294
104 ME8 0.410959 0.806818
105 1ZZ 0.410959 0.806818
106 4UW 0.409091 0.825581
107 NAX 0.409091 0.837209
108 RBY 0.408759 0.843373
109 ADV 0.408759 0.843373
110 ADP MG 0.407407 0.797619
111 P1H 0.405882 0.818182
112 OOB 0.405594 0.864198
113 A A 0.40411 0.829268
114 LAD 0.40411 0.825581
115 UPA 0.403846 0.86747
116 4UU 0.401316 0.833333
117 A3D 0.401235 0.876543
118 DLL 0.4 0.864198
119 XAH 0.4 0.806818
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 5FA6; Ligand: FAD; Similar sites found: 91
This union binding pocket(no: 1) in the query (biounit: 5fa6.bio1) has 70 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 1LJ8 NAD 0.03851 0.40315 1.21704
2 3HQP FDP 0.01208 0.45397 1.40281
3 3RC3 ANP 0.04273 0.42697 1.61812
4 1X9I G6Q 0.03734 0.42327 1.65563
5 2OHH FMN 0.000479 0.49344 1.73267
6 4EI7 GDP 0.02052 0.41372 1.77994
7 3TDC 0EU 0.03166 0.41237 1.94175
8 1E5D FMN 0.0008923 0.47709 1.99005
9 3B5J 12D 0.04287 0.4307 2.05761
10 4IP7 FBP 0.02955 0.42233 2.20994
11 4PPF FLC 0.01924 0.45095 2.28571
12 4AMV F6R 0.03259 0.4201 2.29885
13 1J78 OLA 0.01266 0.45785 2.40175
14 4GLW NMN 0.0463 0.41588 2.62295
15 4D86 ADP 0.0269 0.41578 2.75081
16 3MQ2 SAH 0.03576 0.41506 2.75229
17 2BZZ AP5 0.03803 0.40832 2.96296
18 1G6H ADP 0.03226 0.44092 3.11284
19 4YRY NAD 0.000002864 0.50679 3.26087
20 1BO4 COA 0.02404 0.43737 3.57143
21 3LN9 FLC 0.0006029 0.54625 3.59712
22 4B2D FBP 0.02277 0.42826 3.64964
23 1KZL CRM 0.02157 0.43999 3.84615
24 3KL3 GCU 0.01469 0.41497 4.2394
25 2P3I MNA 0.02331 0.42053 4.96894
26 3CRZ NAP 0.00000000618 0.64283 5.05837
27 3CRZ FAD 0.000008312 0.58192 5.05837
28 4DS0 A2G GAL NAG FUC 0.04419 0.43519 5.52147
29 5E5U MLI 0.008699 0.44491 5.68182
30 3I7V B4P 0.0246 0.46292 5.97015
31 3OZV FAD 0.000698 0.43114 6.45161
32 2OYS FMN 0.03257 0.4091 6.61157
33 2BVE PH5 0.02166 0.42751 6.72269
34 2O2C G6Q 0.0193 0.43201 7.01468
35 2CXS F6P 0.03512 0.4075 7.18133
36 1RLJ FMN 0.000001782 0.63362 7.19424
37 1JJ7 ADP 0.04924 0.42735 7.30769
38 1PVC ILE SER GLU VAL 0.03204 0.42704 7.35294
39 5ITZ GDP 0.03371 0.40359 7.75194
40 5O0X FAD 0.0002349 0.54826 7.90378
41 4U9U FAD 0.0000005627 0.63806 8.8968
42 1T5B FMN 0.01092 0.4382 8.95522
43 5EOO CIT 0.03563 0.43642 9.0566
44 2JBM SRT 0.01376 0.43968 9.699
45 2VNI FAD 0.00000002766 0.6129 9.92647
46 2VNI A2P 0.00000002766 0.6129 9.92647
47 3N39 FMN 0.0002432 0.50329 10.9718
48 1T0I FMN 0.02733 0.41819 11.5183
49 2EIX FAD 0.0006587 0.46977 11.9342
50 1N13 AG2 0.04327 0.43123 12.3894
51 2QQC AG2 0.04916 0.42803 12.5
52 3GFS FMN 0.003701 0.47772 12.6437
53 2PIA FMN 0.0005697 0.49786 13.7072
54 2CND FAD 0.00001864 0.57044 15.9259
55 4N82 FMN 0.000004804 0.61178 16.2921
56 4R2I ANP 0.04186 0.43131 17.1429
57 1QX4 FAD 0.00003618 0.50301 18.2482
58 3JQQ A2P 0.0000006997 0.41012 25
59 2XNJ NAP 0.00002225 0.56669 26.3158
60 2XNJ FAD 0.0005202 0.47748 26.3158
61 2FCR FMN 0.0000001887 0.69123 27.1676
62 2WC1 FMN 0.000000004165 0.75772 29.6703
63 2RC5 FAD 0.00000009409 0.68267 30.2548
64 5NUL FMN 0.0001776 0.53228 30.4348
65 5K9B FMN 0.000000004772 0.75478 30.5556
66 5VW2 FDA 0.00000000008634 0.68646 31.962
67 5VW2 NAP 0.00000000008634 0.68646 31.962
68 1OBV FMN 0.00000001037 0.72947 34.9112
69 2BSA NAP 0.00000000447 0.58716 34.9835
70 2BSA FAD 0.000000006546 0.58547 34.9835
71 1EWY FAD 0.00000003797 0.73655 35.3135
72 1FND A2P 0.0000000001379 0.47875 35.6688
73 1FND FAD 0.0000000001379 0.47875 35.6688
74 1QFY FAD 0.00000000004649 0.49753 35.7143
75 1QFY NAP 0.00000000004649 0.49753 35.7143
76 1GAW FAD 0.0000000023 0.80077 36.3057
77 3VO1 FAD 0.00000000843 0.76101 36.9427
78 1SM4 FAD 0.00000001017 0.75681 37.5
79 3KAP FMN 0.00001034 0.57737 38.7755
80 2QTZ NAP 0.0000000000004496 0.81076 40.4453
81 2QTZ FAD 0.000000003963 0.76813 40.4453
82 1BVY FMN 0.000000001712 0.75886 44.5026
83 2XOD FMN 0.000001428 0.62495 44.5378
84 5LJI FMN 0.00001446 0.59381 44.5946
85 1AKV FMN 0.0000008778 0.6166 45.5782
86 4OXX FMN 0.00000000009197 0.84012 45.679
87 1F20 NAP 0.0000000005956 0.83172 48.5057
88 1F20 FAD 0.0000000001054 0.82684 48.5057
89 1TLL FMN 0.0000000005655 0.76463 49.1909
90 1TLL FAD 0.000000002798 0.75727 49.1909
91 1TLL NAP 0.00000003384 0.66884 49.1909
Pocket No.: 2; Query (leader) PDB : 5FA6; Ligand: FMN; Similar sites found: 91
This union binding pocket(no: 2) in the query (biounit: 5fa6.bio1) has 70 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 1LJ8 NAD 0.03851 0.40315 1.21704
2 3HQP FDP 0.01208 0.45397 1.40281
3 3RC3 ANP 0.04273 0.42697 1.61812
4 1X9I G6Q 0.03734 0.42327 1.65563
5 2OHH FMN 0.000479 0.49344 1.73267
6 4EI7 GDP 0.02052 0.41372 1.77994
7 3TDC 0EU 0.03166 0.41237 1.94175
8 1E5D FMN 0.0008923 0.47709 1.99005
9 3B5J 12D 0.04287 0.4307 2.05761
10 4IP7 FBP 0.02955 0.42233 2.20994
11 4PPF FLC 0.01924 0.45095 2.28571
12 4AMV F6R 0.03259 0.4201 2.29885
13 1J78 OLA 0.01266 0.45785 2.40175
14 4GLW NMN 0.0463 0.41588 2.62295
15 4D86 ADP 0.0269 0.41578 2.75081
16 3MQ2 SAH 0.03576 0.41506 2.75229
17 2BZZ AP5 0.03803 0.40832 2.96296
18 1G6H ADP 0.03226 0.44092 3.11284
19 4YRY NAD 0.000002864 0.50679 3.26087
20 1BO4 COA 0.02404 0.43737 3.57143
21 3LN9 FLC 0.0006029 0.54625 3.59712
22 4B2D FBP 0.02277 0.42826 3.64964
23 1KZL CRM 0.02157 0.43999 3.84615
24 3KL3 GCU 0.01469 0.41497 4.2394
25 2P3I MNA 0.02331 0.42053 4.96894
26 3CRZ NAP 0.00000000618 0.64283 5.05837
27 3CRZ FAD 0.000008312 0.58192 5.05837
28 4DS0 A2G GAL NAG FUC 0.04419 0.43519 5.52147
29 5E5U MLI 0.008699 0.44491 5.68182
30 3I7V B4P 0.0246 0.46292 5.97015
31 3OZV FAD 0.000698 0.43114 6.45161
32 2OYS FMN 0.03257 0.4091 6.61157
33 2BVE PH5 0.02166 0.42751 6.72269
34 2O2C G6Q 0.0193 0.43201 7.01468
35 2CXS F6P 0.03512 0.4075 7.18133
36 1RLJ FMN 0.000001782 0.63362 7.19424
37 1JJ7 ADP 0.04924 0.42735 7.30769
38 1PVC ILE SER GLU VAL 0.03204 0.42704 7.35294
39 5ITZ GDP 0.03371 0.40359 7.75194
40 5O0X FAD 0.0002349 0.54826 7.90378
41 4U9U FAD 0.0000005627 0.63806 8.8968
42 1T5B FMN 0.01092 0.4382 8.95522
43 5EOO CIT 0.03563 0.43642 9.0566
44 2JBM SRT 0.01376 0.43968 9.699
45 2VNI FAD 0.00000002766 0.6129 9.92647
46 2VNI A2P 0.00000002766 0.6129 9.92647
47 3N39 FMN 0.0002432 0.50329 10.9718
48 1T0I FMN 0.02733 0.41819 11.5183
49 2EIX FAD 0.0006587 0.46977 11.9342
50 1N13 AG2 0.04327 0.43123 12.3894
51 2QQC AG2 0.04916 0.42803 12.5
52 3GFS FMN 0.003701 0.47772 12.6437
53 2PIA FMN 0.0005697 0.49786 13.7072
54 2CND FAD 0.00001864 0.57044 15.9259
55 4N82 FMN 0.000004804 0.61178 16.2921
56 4R2I ANP 0.04186 0.43131 17.1429
57 1QX4 FAD 0.00003618 0.50301 18.2482
58 3JQQ A2P 0.0000006997 0.41012 25
59 2XNJ NAP 0.00002225 0.56669 26.3158
60 2XNJ FAD 0.0005202 0.47748 26.3158
61 2FCR FMN 0.0000001887 0.69123 27.1676
62 2WC1 FMN 0.000000004165 0.75772 29.6703
63 2RC5 FAD 0.00000009409 0.68267 30.2548
64 5NUL FMN 0.0001776 0.53228 30.4348
65 5K9B FMN 0.000000004772 0.75478 30.5556
66 5VW2 FDA 0.00000000008634 0.68646 31.962
67 5VW2 NAP 0.00000000008634 0.68646 31.962
68 1OBV FMN 0.00000001037 0.72947 34.9112
69 2BSA NAP 0.00000000447 0.58716 34.9835
70 2BSA FAD 0.000000006546 0.58547 34.9835
71 1EWY FAD 0.00000003797 0.73655 35.3135
72 1FND A2P 0.0000000001379 0.47875 35.6688
73 1FND FAD 0.0000000001379 0.47875 35.6688
74 1QFY FAD 0.00000000004649 0.49753 35.7143
75 1QFY NAP 0.00000000004649 0.49753 35.7143
76 1GAW FAD 0.0000000023 0.80077 36.3057
77 3VO1 FAD 0.00000000843 0.76101 36.9427
78 1SM4 FAD 0.00000001017 0.75681 37.5
79 3KAP FMN 0.00001034 0.57737 38.7755
80 2QTZ NAP 0.0000000000004496 0.81076 40.4453
81 2QTZ FAD 0.000000003963 0.76813 40.4453
82 1BVY FMN 0.000000001712 0.75886 44.5026
83 2XOD FMN 0.000001428 0.62495 44.5378
84 5LJI FMN 0.00001446 0.59381 44.5946
85 1AKV FMN 0.0000008778 0.6166 45.5782
86 4OXX FMN 0.00000000009197 0.84012 45.679
87 1F20 NAP 0.0000000005956 0.83172 48.5057
88 1F20 FAD 0.0000000001054 0.82684 48.5057
89 1TLL FMN 0.0000000005655 0.76463 49.1909
90 1TLL FAD 0.000000002798 0.75727 49.1909
91 1TLL NAP 0.00000003384 0.66884 49.1909
Pocket No.: 3; Query (leader) PDB : 5FA6; Ligand: NAP; Similar sites found: 89
This union binding pocket(no: 3) in the query (biounit: 5fa6.bio1) has 71 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 1LJ8 NAD 0.03947 0.40315 1.21704
2 3HQP FDP 0.01236 0.45397 1.40281
3 3RC3 ANP 0.04361 0.42697 1.61812
4 1X9I G6Q 0.03815 0.42327 1.65563
5 2OHH FMN 0.000495 0.49344 1.73267
6 4EI7 GDP 0.02107 0.41372 1.77994
7 3TDC 0EU 0.03217 0.41237 1.94175
8 1E5D FMN 0.0009215 0.47709 1.99005
9 3B5J 12D 0.04373 0.4307 2.05761
10 4IP7 FBP 0.03024 0.42233 2.20994
11 4PPF FLC 0.01961 0.45095 2.28571
12 4AMV F6R 0.03334 0.4201 2.29885
13 1J78 OLA 0.01291 0.45785 2.40175
14 4AZT SAM 0.0275 0.41858 2.589
15 4GLW NMN 0.0471 0.41588 2.62295
16 4D86 ADP 0.02633 0.41677 2.75081
17 2BZZ AP5 0.03894 0.40832 2.96296
18 1G6H ADP 0.03288 0.44092 3.11284
19 4YRY NAD 0.00000163 0.51603 3.26087
20 1BO4 COA 0.02457 0.43737 3.57143
21 3LN9 FLC 0.0006165 0.54625 3.59712
22 4B2D FBP 0.02331 0.42826 3.64964
23 1KZL CRM 0.02205 0.43999 3.84615
24 3KL3 GCU 0.01494 0.41497 4.2394
25 2P3I MNA 0.02374 0.42053 4.96894
26 3CRZ NAP 0.000000006587 0.64283 5.05837
27 3CRZ FAD 0.000008645 0.58192 5.05837
28 4DS0 A2G GAL NAG FUC 0.04497 0.43519 5.52147
29 5E5U MLI 0.00886 0.44491 5.68182
30 3I7V B4P 0.02501 0.46292 5.97015
31 3OZV FAD 0.0007284 0.43114 6.45161
32 2OYS FMN 0.03338 0.4091 6.61157
33 2BVE PH5 0.02205 0.42751 6.72269
34 2O2C G6Q 0.01976 0.43201 7.01468
35 2CXS F6P 0.03599 0.4075 7.18133
36 1RLJ FMN 0.000001854 0.63362 7.19424
37 1PVC ILE SER GLU VAL 0.0326 0.42704 7.35294
38 5O0X FAD 0.0002419 0.54826 7.90378
39 4U9U FAD 0.0000005849 0.63817 8.8968
40 1T5B FMN 0.0112 0.4382 8.95522
41 5EOO CIT 0.03631 0.43642 9.0566
42 2JBM SRT 0.01403 0.43968 9.699
43 2VNI FAD 0.00000002942 0.6129 9.92647
44 2VNI A2P 0.00000002942 0.6129 9.92647
45 3N39 FMN 0.0002518 0.50329 10.9718
46 1T0I FMN 0.02799 0.41819 11.5183
47 2EIX FAD 0.0006822 0.46977 11.9342
48 1N13 AG2 0.04412 0.43123 12.3894
49 2QQC AG2 0.04636 0.42921 12.5
50 3GFS FMN 0.003797 0.47772 12.6437
51 2PIA FMN 0.0005879 0.49786 13.7072
52 2CND FAD 0.00001934 0.57044 15.9259
53 4N82 FMN 0.00000499 0.61178 16.2921
54 4R2I ANP 0.04271 0.43131 17.1429
55 1QX4 FAD 0.00003782 0.50301 18.2482
56 3JQQ A2P 0.0000007373 0.40747 25
57 2XNJ NAP 0.00002308 0.56669 26.3158
58 2XNJ FAD 0.0005387 0.47748 26.3158
59 2FCR FMN 0.0000001969 0.69123 27.1676
60 2WC1 FMN 0.00000000438 0.75772 29.6703
61 2RC5 FAD 0.00000009854 0.68267 30.2548
62 5NUL FMN 0.0001834 0.53228 30.4348
63 5K9B FMN 0.000000005018 0.75478 30.5556
64 5VW2 FDA 0.00000000009333 0.68646 31.962
65 5VW2 NAP 0.00000000009333 0.68646 31.962
66 1OBV FMN 0.0000000109 0.72947 34.9112
67 2BSA NAP 0.000000004827 0.58716 34.9835
68 2BSA FAD 0.000000007055 0.58547 34.9835
69 1EWY FAD 0.00000003969 0.73655 35.3135
70 1FND A2P 0.0000000001479 0.475 35.6688
71 1FND FAD 0.0000000001479 0.475 35.6688
72 1QFY NAP 0.00000000005007 0.49354 35.7143
73 1QFY FAD 0.00000000005007 0.49354 35.7143
74 1GAW FAD 0.000000002415 0.80077 36.3057
75 3VO1 FAD 0.00000000884 0.76101 36.9427
76 1SM4 FAD 0.00000001066 0.75681 37.5
77 3KAP FMN 0.00001075 0.57737 38.7755
78 2QTZ NAP 0.0000000000004885 0.81076 40.4453
79 2QTZ FAD 0.000000004165 0.76813 40.4453
80 1BVY FMN 0.000000001807 0.75886 44.5026
81 2XOD FMN 0.000001489 0.62495 44.5378
82 5LJI FMN 0.00001498 0.59381 44.5946
83 1AKV FMN 0.0000009178 0.6166 45.5782
84 4OXX FMN 0.00000000009735 0.84012 45.679
85 1F20 NAP 0.0000000006266 0.83172 48.5057
86 1F20 FAD 0.0000000001117 0.82684 48.5057
87 1TLL FMN 0.0000000005991 0.76463 49.1909
88 1TLL FAD 0.000000002947 0.75727 49.1909
89 1TLL NAP 0.00000003565 0.66884 49.1909
Pocket No.: 4; Query (leader) PDB : 5FA6; Ligand: FAD; Similar sites found: 18
This union binding pocket(no: 4) in the query (biounit: 5fa6.bio2) has 71 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 4AFK FLC 0.02828 0.41548 1.52838
2 2POC BG6 0.01568 0.44071 1.63488
3 4AZT SAM 0.04526 0.4076 2.589
4 2WPX ACO 0.04891 0.40588 2.65487
5 1MZC SUC 0.02153 0.44453 2.91262
6 2FN1 SAL 0.03981 0.42925 3.43249
7 5DUS APR 0.0421 0.4018 3.57143
8 5LAU AR6 0.02294 0.40961 3.84615
9 2WZF BGC 0.04159 0.43104 4.19048
10 1KQR MNA 0.01165 0.44122 4.46927
11 3M89 GSP 0.02637 0.43206 4.68384
12 4K91 SIN 0.04761 0.41132 5.78035
13 4IF4 BEF 0.04976 0.42515 6.25
14 2Z48 A2G 0.04658 0.42251 6.94444
15 3JU6 ARG 0.03685 0.43279 7.02703
16 4ONT SIA GAL BGC 0.03717 0.43267 9.30233
17 4V3I ASP LEU THR ARG PRO 0.04662 0.42954 9.72763
18 4J5R A1R 0.03037 0.40625 13.6986
Pocket No.: 5; Query (leader) PDB : 5FA6; Ligand: NAP; Similar sites found: 20
This union binding pocket(no: 5) in the query (biounit: 5fa6.bio2) has 72 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 4AFK FLC 0.02878 0.41548 1.52838
2 2POC BG6 0.01605 0.44071 1.63488
3 2WPX ACO 0.0473 0.40712 2.65487
4 3MQ2 SAH 0.04649 0.41017 2.75229
5 1MZC SUC 0.02199 0.44453 2.91262
6 5UDS ATP 0.04488 0.42321 3.14685
7 2FN1 SAL 0.04062 0.42925 3.43249
8 5DUS APR 0.04312 0.4018 3.57143
9 5LAU AR6 0.02355 0.40961 3.84615
10 2WZF BGC 0.0424 0.43104 4.19048
11 3S6X SIA GAL BGC 0.03603 0.42859 4.30769
12 1KQR MNA 0.01187 0.44122 4.46927
13 3M89 GSP 0.02696 0.43206 4.68384
14 4K91 SIN 0.04842 0.41132 5.78035
15 2Z48 A2G 0.0474 0.42251 6.94444
16 3JU6 ARG 0.03754 0.43279 7.02703
17 5ITZ GDP 0.0178 0.4177 7.75194
18 4ONT SIA GAL BGC 0.03788 0.43267 9.30233
19 4V3I ASP LEU THR ARG PRO 0.04749 0.42954 9.72763
20 4J5R A1R 0.03114 0.40625 13.6986
Pocket No.: 6; Query (leader) PDB : 5FA6; Ligand: FMN; Similar sites found: 13
This union binding pocket(no: 6) in the query (biounit: 5fa6.bio2) has 70 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 4AFK FLC 0.02777 0.41548 1.52838
2 2POC BG6 0.01531 0.44071 1.63488
3 4AZT SAM 0.04423 0.4076 2.589
4 1MZC SUC 0.02106 0.44453 2.91262
5 2FN1 SAL 0.039 0.42925 3.43249
6 5LAU AR6 0.02751 0.40543 3.84615
7 2WZF BGC 0.04079 0.43104 4.19048
8 1KQR MNA 0.01142 0.44122 4.46927
9 4K91 SIN 0.04679 0.41132 5.78035
10 4IF4 BEF 0.04888 0.42515 6.25
11 2Z48 A2G 0.04576 0.42251 6.94444
12 3JU6 ARG 0.03617 0.43279 7.02703
13 4ONT SIA GAL BGC 0.03646 0.43267 9.30233
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