Receptor
PDB id Resolution Class Description Source Keywords
4YSX 2.25 Å EC: 1.3.5.1 CRYSTAL STRUCTURE OF MITOCHONDRIAL RHODOQUINOL-FUMARATE REDU ASCARIS SUUM WITH THE SPECIFIC INHIBITOR NN23 ASCARIS SUUM RHODOQUINOL-FUMARATE REDUCTASE COMPLEX II OXIDOREDUCTASE- OXIDOREDUCTASE INHIBITOR COMPLEX
Ref.: STRUCTURAL INSIGHTS INTO THE MOLECULAR DESIGN OF FL DERIVATIVES TARGETED FOR FUMARATE RESPIRATION OF PA MITOCHONDRIA INT J MOL SCI V. 16 15287 2015
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
F3S F:303;
B:303;
Part of Protein;
Part of Protein;
none;
none;
submit data
295.795 Fe3 S4 S1[Fe...
SF4 B:302;
F:302;
Part of Protein;
Part of Protein;
none;
none;
submit data
351.64 Fe4 S4 [S]12...
E23 B:304;
G:202;
Valid;
Valid;
none;
none;
ic50 = 0.0055 uM
335.363 C19 H20 F3 N O CC(C)...
EPH D:201;
H:201;
Valid;
Valid;
Atoms found LESS than expected: % Diff = 0.102;
Atoms found LESS than expected: % Diff = 0.102;
submit data
709.933 C39 H68 N O8 P CCCC=...
MLI E:701;
A:701;
Valid;
Valid;
none;
none;
submit data
102.046 C3 H2 O4 C(C(=...
FES F:301;
B:301;
Part of Protein;
Part of Protein;
none;
none;
submit data
175.82 Fe2 S2 S1[Fe...
HEM C:201;
G:201;
Part of Protein;
Part of Protein;
none;
none;
submit data
616.487 C34 H32 Fe N4 O4 Cc1c2...
FAD A:702;
E: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
4YSX 2.25 Å EC: 1.3.5.1 CRYSTAL STRUCTURE OF MITOCHONDRIAL RHODOQUINOL-FUMARATE REDU ASCARIS SUUM WITH THE SPECIFIC INHIBITOR NN23 ASCARIS SUUM RHODOQUINOL-FUMARATE REDUCTASE COMPLEX II OXIDOREDUCTASE- OXIDOREDUCTASE INHIBITOR COMPLEX
Ref.: STRUCTURAL INSIGHTS INTO THE MOLECULAR DESIGN OF FL DERIVATIVES TARGETED FOR FUMARATE RESPIRATION OF PA MITOCHONDRIA INT J MOL SCI V. 16 15287 2015
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 3 families.
1 4YSX ic50 = 0.0055 uM E23 C19 H20 F3 N O CC(C)(C)c1....
70% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 4YSX ic50 = 0.0055 uM E23 C19 H20 F3 N O CC(C)(C)c1....
50% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 4YSX ic50 = 0.0055 uM E23 C19 H20 F3 N O CC(C)(C)c1....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: E23; Similar ligands found: 1
No: Ligand ECFP6 Tc MDL keys Tc
1 E23 1 1
Ligand no: 2; Ligand: EPH; Similar ligands found: 70
No: Ligand ECFP6 Tc MDL keys Tc
1 EPH 1 1
2 GP7 0.847059 1
3 L9Q 0.752941 1
4 LOP 0.752941 1
5 PEK 0.741573 1
6 ZPE 0.715909 1
7 PSC 0.673684 0.79661
8 PEH 0.647059 0.980769
9 PTY 0.647059 0.980769
10 PEF 0.647059 0.980769
11 8PE 0.647059 0.980769
12 PEV 0.647059 0.980769
13 9PE 0.639535 0.980769
14 PCW 0.634409 0.79661
15 PGW 0.595745 0.830189
16 DR9 0.589474 0.830189
17 PGV 0.589474 0.830189
18 P6L 0.583333 0.830189
19 DLP 0.58 0.728814
20 OZ2 0.57732 0.830189
21 T7X 0.563107 0.711864
22 B7N 0.555556 0.711864
23 LIO 0.537634 0.779661
24 HGX 0.537634 0.779661
25 PC7 0.537634 0.779661
26 PLD 0.537634 0.779661
27 HGP 0.537634 0.779661
28 6PL 0.537634 0.779661
29 PEE 0.532609 0.962264
30 L9R 0.53 0.728814
31 PIE 0.519608 0.666667
32 XP5 0.516129 0.779661
33 CD4 0.51087 0.807692
34 P5S 0.505263 0.888889
35 P3A 0.504854 0.796296
36 LHG 0.5 0.811321
37 PGT 0.5 0.811321
38 PCK 0.480769 0.741935
39 CN3 0.47 0.807692
40 3PH 0.466667 0.773585
41 7PH 0.466667 0.773585
42 6PH 0.466667 0.773585
43 LPP 0.466667 0.773585
44 PII 0.464646 0.694915
45 3PE 0.463918 0.867925
46 PSF 0.463158 0.888889
47 PX2 0.461538 0.754717
48 7P9 0.461538 0.773585
49 44G 0.457447 0.811321
50 PIZ 0.451923 0.694915
51 42H 0.45098 0.830508
52 CN6 0.45 0.807692
53 PGK 0.447619 0.767857
54 PD7 0.444444 0.773585
55 CDL 0.443299 0.735849
56 IP9 0.442308 0.694915
57 PCF 0.44 0.711864
58 PC1 0.44 0.711864
59 MC3 0.44 0.711864
60 DGG 0.435185 0.767857
61 S12 0.427184 0.888889
62 PIF 0.427184 0.683333
63 M7U 0.424242 0.773585
64 44E 0.422222 0.773585
65 8ND 0.419355 0.716981
66 PDK 0.418803 0.819672
67 NKP 0.416667 0.792453
68 PIO 0.415094 0.683333
69 52N 0.415094 0.683333
70 AGA 0.401961 0.777778
Ligand no: 3; Ligand: MLI; Similar ligands found: 4
No: Ligand ECFP6 Tc MDL keys Tc
1 MLI 1 1
2 OAA 0.5 0.666667
3 SIN 0.5 0.785714
4 OXL 0.416667 0.642857
Ligand no: 4; 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 : 4YSX; Ligand: E23; Similar sites found: 136
This union binding pocket(no: 1) in the query (biounit: 4ysx.bio2) has 14 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 4DV8 0LX 0.01663 0.42899 3.7234
2 4WAS COO 0.02386 0.42254 3.84615
3 3MBG FAD 0.009927 0.43092 4.31655
4 1GHE ACO 0.02436 0.40756 4.51977
5 2D5Z L35 0.03499 0.43742 4.96454
6 4V3I ASP LEU THR ARG PRO 0.005237 0.4288 5.12821
7 3TDC 0EU 0.02957 0.40928 5.12821
8 3RUU 37G 0.03213 0.40663 5.24017
9 5TO8 7FM 0.02368 0.4237 5.31915
10 1FCH TYR GLN SER LYS LEU 0.01273 0.41734 5.31915
11 4M26 SIN 0.03449 0.4024 5.49451
12 4M26 ZZU 0.03449 0.4024 5.49451
13 3B6C SDN 0.004419 0.42224 5.55556
14 2P1C GG3 0.004274 0.45444 5.67376
15 1U3D FAD 0.03857 0.40237 5.76923
16 4UHL VFV 0.02541 0.40189 5.8296
17 4RW3 TDA 0.02645 0.40946 5.85106
18 4EKQ NPO 0.01571 0.40903 5.88235
19 4XB4 45D 0.01788 0.41304 5.92105
20 3T4L ZEA 0.008142 0.42352 6.2963
21 4RC8 STE 0.01018 0.42574 6.30631
22 4GFD 0YB 0.01701 0.41571 6.38298
23 4Q86 AMP 0.0009278 0.41514 6.38298
24 5HCN DAO 0.003256 0.42867 6.41026
25 1QZR ANP 0.02363 0.41111 6.45933
26 2O5L MNR 0.006333 0.42697 6.53595
27 4O6M C5P 0.01112 0.41666 7.05128
28 5F1R 42O 0.03796 0.40019 7.05128
29 4IEH 1E9 0.01987 0.41219 7.10059
30 3V49 PK0 0.02776 0.40602 7.14286
31 1M13 HYF 0.01665 0.42556 7.27848
32 2FV5 541 0.03351 0.40806 7.27969
33 5LJB RTL 0.02503 0.40223 7.40741
34 3A7R LAQ 0.03091 0.41538 7.44681
35 4MNS 2AX 0.009729 0.45315 7.54717
36 2EV1 OLA 0.02238 0.40797 7.65766
37 4OAR 2S0 0.002382 0.4546 7.69231
38 1FBY REA 0.003209 0.45337 7.69231
39 1SR7 MOF 0.006064 0.44901 7.69231
40 4M8E 29V 0.009344 0.42766 7.69231
41 5O4J PJL 0.04475 0.40454 7.69231
42 3FAL LO2 0.04106 0.40442 7.69231
43 3FAL REA 0.01497 0.40158 7.69231
44 2E9L PLM 0.0363 0.41254 7.80142
45 2E9L BGC 0.03778 0.41254 7.80142
46 2E9L OLA 0.03778 0.41254 7.80142
47 4NB5 2JT 0.01485 0.41213 8.18713
48 4IGH 1EA 0.02731 0.43826 8.33333
49 4IGH FMN 0.02731 0.43826 8.33333
50 4IGH ORO 0.02731 0.43826 8.33333
51 2J8C U10 0.02768 0.43792 8.33333
52 2J8C SPO 0.02768 0.43792 8.33333
53 1TV5 N8E 0.004224 0.43187 8.33333
54 2A1L PCW 0.03869 0.4164 8.33333
55 3T58 FAD 0.03804 0.40392 8.86525
56 2VWA PTY 0.007978 0.41767 8.91089
57 5IR4 ZPE 0.005792 0.46111 8.97436
58 2QE4 JJ3 0.02281 0.43479 8.97436
59 5AAV GW5 0.02617 0.43356 8.97436
60 1RX0 2MC 0.02984 0.40574 8.97436
61 2Q2Y ADP 0.04779 0.42893 8.99183
62 2Q2Y MKR 0.04779 0.42893 8.99183
63 4UCC ZKW 0.006132 0.42475 9.01288
64 1YMT DR9 0.01414 0.42559 9.04255
65 3UP3 XCA 0.005875 0.43974 9.0535
66 1S8G DAO 0.01039 0.4118 9.09091
67 4NU0 AP5 0.0454 0.40905 9.21659
68 4LWU 20U 0.001058 0.41345 9.41177
69 4ZOM 4Q3 0.03688 0.43402 9.57447
70 5NTW 98N 0.02698 0.41429 9.57447
71 5ECP ATP 0.02911 0.42066 9.61539
72 5ECP JAA 0.02801 0.42066 9.61539
73 5ECP MET 0.02801 0.42066 9.61539
74 5KD8 TNR 0.009587 0.4059 9.61539
75 1FWV SGA MAG FUC 0.01205 0.40758 9.70149
76 2JHP GUN 0.00772 0.41391 9.93789
77 3KDU NKS 0.008395 0.44829 10.1083
78 2ZFZ ARG 0.04417 0.44052 10.1266
79 5AZC PGT 0.02323 0.44887 10.2564
80 5K52 OCD 0.01124 0.42184 10.2564
81 4KCF AKM 0.03142 0.40176 10.2837
82 3QKD HI0 0.0185 0.41528 10.4972
83 2Z7I 742 0.03071 0.43647 10.5882
84 2QHD DAO 0.01069 0.4517 10.6557
85 3KFC 61X 0.01448 0.43 11.1702
86 3LLI FAD 0.01924 0.41717 11.1702
87 3KRO IPE 0.02537 0.40947 11.1702
88 3KRO DST 0.02537 0.40947 11.1702
89 4CA5 3EF 0.01536 0.44369 11.5385
90 1M2Z BOG 0.01279 0.42397 11.5385
91 4QWT ACD 0.02199 0.41276 11.5385
92 3BQD DAY 0.0237 0.40509 11.5385
93 3IX8 TX3 0.01074 0.42765 11.5607
94 4HBM 0Y7 0.0007769 0.40762 11.6667
95 1JF0 CZH 0.0352 0.40057 11.7949
96 1VJY 460 0.0424 0.40367 12.0567
97 3L9R L9R 0.02169 0.42166 12.2449
98 4OMJ 2TX 0.006362 0.44914 12.5899
99 4DOL PLM 0.01416 0.41132 12.8205
100 5U98 1KX 0.02454 0.43718 13.1313
101 5U98 VAL THR THR ASP ILE GLN VAL LYS VAL 0.02659 0.41347 13.1313
102 5L2J 6UL 0.005783 0.47629 13.2653
103 5L2J 70E 0.006096 0.47629 13.2653
104 4OGN 2U5 0.0129 0.41526 13.3333
105 3GWN FAD 0.02392 0.40325 14.0351
106 3E85 BSU 0.006389 0.45578 14.1026
107 2CDN ADP 0.0279 0.40141 14.1026
108 1JXZ BCA 0.04102 0.40094 14.1264
109 3WMX THR 0.01697 0.40299 14.1844
110 4OAS 2SW 0.0004278 0.42647 14.5833
111 5IF4 6AK 0.03098 0.41633 14.7436
112 3QCP FAD 0.01245 0.42575 14.8936
113 1TW4 CHD 0.003314 0.40275 15.2
114 5KOR GDP 0.002427 0.45418 15.3846
115 4P6X HCY 0.007858 0.44423 15.3846
116 1YUC EPH 0.03403 0.4077 15.4255
117 3FMI KAP 0.008661 0.42768 15.5378
118 1BWO LPC 0.02299 0.4024 15.5556
119 3G9E RO7 0.003792 0.46241 15.9574
120 1RV1 IMZ 0.002806 0.44004 16.4706
121 4QYN RTL 0.02814 0.40278 16.5414
122 3WYJ H78 0.01453 0.45341 16.6667
123 2B4D COA 0.02746 0.40014 16.9591
124 5KAU RHQ 0.01234 0.41625 16.9697
125 3SCM LGN 0.01284 0.45107 17.1717
126 3G08 FEE 0.01712 0.44329 17.1717
127 1FO0 ILE ASN PHE ASP PHE ASN THR ILE 0.02658 0.42284 17.1717
128 3H0A D30 0.007382 0.43912 18.0851
129 5CSD ACD 0.02835 0.41744 18.239
130 1JR8 FAD 0.01872 0.41201 18.8034
131 5V4R MGT 0.01549 0.40852 24.0741
132 4B1W ATP 0.02919 0.40195 28.125
133 4JD3 PLM 0.03573 0.41916 30.1282
134 4JD3 COA 0.03334 0.41916 30.1282
135 3T03 3T0 0.01227 0.4125 38.8889
136 5X8Q 82R 0.02466 0.40085 40.9091
Pocket No.: 2; Query (leader) PDB : 4YSX; Ligand: FAD; Similar sites found: 567
This union binding pocket(no: 2) in the query (biounit: 4ysx.bio2) has 41 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 4RPL FAD 0.000003869 0.51429 3.20513
2 4RPL 3UC 0.000005428 0.5117 3.20513
3 3VSE SAH 0.00414 0.45354 3.20513
4 3A4T SFG 0.001432 0.44805 3.20513
5 2EJU SAH 0.008441 0.42316 3.43915
6 3NJ4 NAD 0.002197 0.43679 3.44828
7 3NJ4 AFX 0.004985 0.42283 3.44828
8 3QJ4 FAD 0.00000001737 0.57832 3.7234
9 2CVZ NDP 0.001581 0.43333 3.7234
10 3KB6 NAD 0.001806 0.42806 3.7234
11 1XHC FAD 0.000000007555 0.60069 3.84615
12 2Y6Q I7T 0.0000001192 0.5503 3.84615
13 2Y6Q FAD 0.000000005291 0.54955 3.84615
14 3B20 NAD 0.0003927 0.46529 3.84615
15 1L7N ALF 0.01057 0.44185 3.84615
16 2GZ3 NAP 0.001228 0.41324 3.84615
17 2R4J FAD 0.0000003058 0.54272 3.90071
18 2R4J 13P 0.0000003058 0.54272 3.90071
19 5GZ6 NDP 0.0003437 0.47952 3.90071
20 5GZ6 7C3 0.0006069 0.4608 3.90071
21 4G74 FAD 0.00000007827 0.56433 3.98406
22 4G74 UQ5 0.0000003816 0.4895 3.98406
23 4M52 FAD 0.000000008902 0.58271 4.07725
24 2A8X FAD 0.00000001985 0.54912 4.09483
25 1QKQ MAN 0.03846 0.41181 4.22535
26 3OJO NAD 0.00000254 0.56401 4.25532
27 4REP FAD 0.00000003699 0.55464 4.25532
28 2B9W FAD 0.0000005598 0.53705 4.25532
29 1CER NAD 0.0001603 0.47429 4.25532
30 1NPD NAD 0.0005079 0.46053 4.25532
31 3LU1 NAD 0.001401 0.42692 4.25532
32 4E5N NAD 0.0002725 0.40154 4.25532
33 2JB2 PHE 0.00000008241 0.54649 4.48718
34 2JB2 FAD 0.00000006503 0.54649 4.48718
35 3NT6 FAD 0.0000001717 0.5437 4.48718
36 3NTD FAD 0.0000001006 0.53624 4.48718
37 3NTA FAD 0.00000009968 0.53573 4.48718
38 3QVP FAD 0.0000008655 0.51636 4.48718
39 3V1Y NAD 0.00003632 0.50086 4.48718
40 4JK3 NAD 0.00003864 0.49975 4.48718
41 1NAA 6FA 0.000001101 0.49493 4.48718
42 1YKJ PHB 0.00000007312 0.46133 4.48718
43 1YKJ FAD 0.00000007312 0.46133 4.48718
44 1NAA ABL 0.000002303 0.45144 4.48718
45 1YXM ADE 0.007665 0.44472 4.48718
46 3SJU NDP 0.001282 0.42573 4.48718
47 2F5X ASP 0.03545 0.41681 4.48718
48 5GM1 SAH 0.006985 0.4147 4.48718
49 3CIF NAD 0.00006758 0.41344 4.48718
50 3H2B SAH 0.01195 0.41299 4.48718
51 4EIP K2C 0.00000007171 0.5158 4.55373
52 4EIP FAD 0.00000007171 0.5158 4.55373
53 2WPF WPF 0.0000006473 0.566 4.64646
54 2WPF FAD 0.0000007067 0.5624 4.64646
55 5TUK FAD 0.0000001603 0.59227 4.65686
56 1RKX NAD 0.004064 0.40636 4.7619
57 2YG3 FAD 0.00000003514 0.55901 4.78723
58 5J7X FAD 0.000001413 0.51185 4.78723
59 2ZXI FAD 0.00000006713 0.56225 4.8062
60 1V59 NAD 0.000000162 0.67772 4.81172
61 1V59 FAD 0.00000001712 0.54013 4.81172
62 1COY FAD 0.000003608 0.49239 4.96124
63 1COY AND 0.00001739 0.48505 4.96124
64 4USR FAD 0.0000001448 0.5684 4.98615
65 4HXY NDP 0.0000927 0.4698 5.02283
66 2V3A FAD 0.000000008796 0.5886 5.12821
67 2CDU FAD 0.00000001702 0.55261 5.12821
68 3EGI ADP 0.001999 0.4854 5.12821
69 1L3I SAH 0.001368 0.43898 5.12821
70 2CDU ADP 0.00000005765 0.43652 5.12821
71 1I36 NAP 0.004659 0.42538 5.12821
72 3LKZ SFG 0.008523 0.41975 5.12821
73 1VL8 NAP 0.002276 0.41124 5.12821
74 1SC6 NAD 0.0001838 0.41023 5.12821
75 1LJ8 NAD 0.01031 0.41008 5.12821
76 3MQ2 SAH 0.02823 0.40131 5.12821
77 5TUF FAD 0.000000001669 0.64692 5.13447
78 5TUF TDC 0.00000009137 0.46671 5.13447
79 1TPY SAH 0.00989 0.41089 5.22648
80 4JNA FAD 0.0000001472 0.52686 5.31915
81 4K5S PM0 0.00004363 0.50037 5.31915
82 4K5S FAD 0.00001302 0.50037 5.31915
83 1V8B NAD 0.0001039 0.4297 5.31915
84 1DL5 SAH 0.006739 0.40734 5.31915
85 1YJQ NAP 0.0003912 0.40203 5.31915
86 2HNK SAH 0.004444 0.42946 5.43933
87 1G55 SAH 0.007936 0.42118 5.53936
88 5EZ7 FAD 0.00000003872 0.55381 5.61225
89 1O5I NAD 0.01746 0.40537 5.62249
90 3MJE NDP 0.0009697 0.43319 5.64516
91 1N2X SAM 0.007569 0.41318 5.64784
92 1OMO NAD 0.0001058 0.48958 5.67376
93 4D04 NAP 0.0000006006 0.43522 5.67376
94 4D04 FAD 0.0000006006 0.43522 5.67376
95 4NTD FAD 0.004018 0.41457 5.67376
96 2HJR APR 0.00001759 0.40802 5.67376
97 1PN0 IPH 0.00000001236 0.58741 5.76923
98 1PN0 FAD 0.00000001119 0.58741 5.76923
99 3S5W FAD 0.0000002222 0.571 5.76923
100 3S5W NAP 0.0000933 0.52545 5.76923
101 2DT5 NAD 0.0001122 0.4734 5.76923
102 4GKV NAD 0.0004212 0.43596 5.76923
103 3OND ADN 0.0002576 0.43589 5.76923
104 3OND NAD 0.0002576 0.43589 5.76923
105 4HA6 FAD 0.002318 0.42872 5.76923
106 5BR7 FAD 0.00000318 0.42655 5.76923
107 1J0X NAD 0.0004328 0.42397 5.76923
108 5BR7 FLC 0.000004052 0.42342 5.76923
109 5F8F SFG 0.01355 0.42 5.76923
110 3GWZ SAH 0.03276 0.40113 5.76923
111 3ICT ADP 0.00000001875 0.72534 5.85106
112 3ICR FAD 0.00000002513 0.57731 5.85106
113 3ICT FAD 0.00000003277 0.57324 5.85106
114 4RDH AMP 0.00001067 0.57132 5.85106
115 4D79 ATP 0.000011 0.55816 5.85106
116 3ICS FAD 0.00000003558 0.55082 5.85106
117 1I8T FAD 0.0000008493 0.51584 5.85106
118 4YCA NDP 0.00006967 0.4892 5.85106
119 1GUZ NAD 0.00006109 0.48393 5.85106
120 3FPZ AHZ 0.002405 0.45034 5.85106
121 4DSG UDP 0.0000004651 0.44938 5.85106
122 4DSG FAD 0.0000004651 0.44938 5.85106
123 5M67 NAD 0.0002706 0.43614 5.85106
124 5M67 ADE 0.0002716 0.43609 5.85106
125 5M67 3D1 0.0003134 0.43392 5.85106
126 3ICS ADP 0.00000003231 0.4194 5.85106
127 2B4R NAD 0.000104 0.41457 5.85106
128 4DPL NAP 0.004775 0.406 5.85106
129 4K28 NAD 0.00004102 0.50282 5.94796
130 4JGP PYR 0.01659 0.4362 5.99078
131 2XVM SAH 0.0122 0.42582 6.03015
132 3GRU AMP 0.0002979 0.47421 6.1017
133 3GDN HBX 0.000002626 0.5087 6.14203
134 3GDN FAD 0.000001452 0.50726 6.14203
135 5TWJ SAM 0.01948 0.40318 6.17284
136 3LXD FAD 0.00000001225 0.59816 6.38298
137 5TTJ FAD 0.00000008583 0.54998 6.38298
138 2NPX FAD 0.0000004295 0.5338 6.38298
139 4UP3 FAD 0.0000002467 0.53038 6.38298
140 1W73 NAP 0.001119 0.44588 6.38298
141 2NPX NAD 0.000001268 0.4424 6.38298
142 1W6U NAP 0.003077 0.42715 6.38298
143 3HDY FAD 0.000007635 0.41652 6.38298
144 3HDY FDA 0.000007793 0.41637 6.38298
145 5UAV TFB 0.000314 0.41493 6.38298
146 5UAV NDP 0.000314 0.41493 6.38298
147 3HDY GDU 0.000008276 0.41322 6.38298
148 3IHG FAD 0.000000006777 0.6416 6.41026
149 1PS9 FAD 0.00000007509 0.54951 6.41026
150 1X87 NAD 0.00001981 0.52531 6.41026
151 4Z24 FAD 0.0000004396 0.51213 6.41026
152 4USQ FAD 0.00008432 0.47204 6.41026
153 4ZRN NAD 0.0006336 0.42942 6.41026
154 1TDF NAP 0.006632 0.42875 6.41026
155 1TDF FAD 0.002832 0.42818 6.41026
156 2C04 GCP 0.0103 0.42239 6.41026
157 4KRG SAH 0.02463 0.40725 6.41026
158 1PS9 NAP 0.00009735 0.40093 6.41026
159 2JAP NDP 0.002879 0.41215 6.47773
160 2VT3 ATP 0.000001941 0.62287 6.51163
161 3ITJ FAD 0.0000009824 0.52244 6.73759
162 2XVF FAD 0.000001047 0.52014 6.73759
163 2XVE FAD 0.000005728 0.50525 6.73759
164 4U8P FDA 0.0000003781 0.43243 6.73759
165 4U8P UDP 0.0000004304 0.42557 6.73759
166 3HAD NAD 0.001887 0.40673 6.73759
167 2Q7V FAD 0.000000005821 0.58723 6.76923
168 2D2I NAP 0.0007629 0.45649 6.84211
169 2YPI PGA 0.03764 0.40783 6.88259
170 3WGT FAD 0.00000000434 0.60169 6.91489
171 3WGT QSC 0.000000006294 0.59762 6.91489
172 4EMI NAD 0.0000001189 0.56569 6.91489
173 4EMJ FAD 0.00000003585 0.56299 6.91489
174 4EMI FAD 0.00000002981 0.5536 6.91489
175 4MIG G3F 0.0000003435 0.53709 6.91489
176 4RSL FAD 0.000002992 0.50767 6.91489
177 4TM3 FAD 0.00001535 0.49608 6.91489
178 2PV7 NAD 0.0003988 0.45466 6.91489
179 2PZM NAD 0.001395 0.40656 6.91489
180 2PZM UDP 0.001395 0.40656 6.91489
181 4YAG NAI 0.001193 0.40787 6.92042
182 1FEC FAD 0.0000001036 0.5524 6.93878
183 2D5A COA 0.009561 0.40876 6.94444
184 2BKX F6R 0.01045 0.42918 7.02479
185 3QWI NAP 0.002168 0.41444 7.03704
186 3OZ2 FAD 0.000000004893 0.58797 7.05128
187 2VHW NAI 0.00004936 0.46407 7.05128
188 5H81 NAP 0.0006889 0.46209 7.05128
189 3GD4 FAD 0.0000004338 0.45441 7.05128
190 2DC1 NAD 0.0007159 0.44436 7.05128
191 1E5Q NDP 0.001639 0.42696 7.05128
192 3GD4 NAD 0.0000004401 0.41695 7.05128
193 1NVT NAP 0.0002065 0.47719 7.0922
194 3PT9 SAH 0.001525 0.45799 7.0922
195 4AP3 NAP 0.000001418 0.43363 7.0922
196 4AP3 FAD 0.000001418 0.43363 7.0922
197 5AYV KPL 0.0006526 0.40135 7.11974
198 2JAH NDP 0.003108 0.41087 7.28745
199 5KOK SAH 0.02101 0.40166 7.30479
200 1LLU NAD 0.0005612 0.40041 7.30994
201 4MO2 FDA 0.0000005914 0.52889 7.44186
202 4MO2 FAD 0.0000006022 0.52474 7.44186
203 3FG2 FAD 0.00000003884 0.5898 7.44681
204 4IV9 FAD 0.00000000609 0.58476 7.44681
205 3UCL NAP 0.000001118 0.53768 7.44681
206 3UCL CYH 0.0000009309 0.53768 7.44681
207 3UCL FAD 0.0000009309 0.53768 7.44681
208 5MQ6 NDP 0.00002796 0.51881 7.44681
209 2VYN NAD 0.00003537 0.49339 7.44681
210 1BXK NAD 0.0002147 0.46217 7.44681
211 2FR1 NDP 0.000258 0.44961 7.44681
212 2Q1W NAD 0.0003566 0.44141 7.44681
213 1C0I BE2 0.003279 0.42482 7.44681
214 1C0I FAD 0.003279 0.42482 7.44681
215 1KPG SAH 0.0109 0.409 7.44681
216 2O4C NAD 0.000159 0.40773 7.44681
217 1RPN NDP 0.00425 0.40331 7.46269
218 1VDC FAD 0.01224 0.40438 7.50751
219 3OA2 NAD 0.001489 0.42863 7.54717
220 4OSP NAP 0.004295 0.41026 7.60456
221 1ZBQ NAD 0.001116 0.42542 7.64526
222 3E1T FAD 0.000000001873 0.60758 7.69231
223 5VN0 FAD 0.00000003571 0.56743 7.69231
224 5I39 FAD 0.00000004595 0.56362 7.69231
225 5VN0 NAI 0.0000005201 0.44914 7.69231
226 4ISS TAR 0.01959 0.42999 7.69231
227 4O0L NDP 0.002394 0.41525 7.69231
228 5GWX SAM 0.004472 0.4147 7.69231
229 5GWX SAR 0.004472 0.4147 7.69231
230 3ORF NAD 0.003369 0.41447 7.69231
231 3E70 GDP 0.02965 0.40977 7.69231
232 4TXI FAD 0.00000001011 0.61717 7.80142
233 2Q0L FAD 0.00000003569 0.55255 7.80142
234 4ZCC FAD 0.000000005434 0.53157 7.80142
235 4ZCC NAI 0.000000005434 0.53157 7.80142
236 2Q0L NAP 0.0001899 0.51041 7.80142
237 1OBB NAD 0.0036 0.42423 7.80142
238 1LSS NAD 0.000001196 0.59018 7.85714
239 1ZK7 FAD 0.0008415 0.44757 7.92291
240 3KU0 ADE 0.03547 0.41513 7.96813
241 4II2 ATP 0.00002029 0.53484 7.97546
242 4JDR FAD 0.000000008887 0.58099 7.97872
243 2Z3Y F2N 0.00000001676 0.575 7.97872
244 1E1M FAD 0.00000008322 0.56392 7.97872
245 1E1M NAP 0.00000008322 0.56392 7.97872
246 1RSG FAD 0.00000001804 0.55648 7.97872
247 4D7E FAD 0.000004169 0.4771 7.97872
248 4DMG SAM 0.02318 0.41528 7.97872
249 1KPH SAH 0.01099 0.40885 7.97872
250 1ORR NAD 0.002905 0.40727 7.97872
251 4CS9 AMP 0.03456 0.40583 7.97872
252 5KKA 6V0 0.0003002 0.40406 7.97872
253 5UAO FAD 0.00000007961 0.54014 8.15603
254 1U8X NAD 0.008208 0.40379 8.15603
255 2Q46 NAP 0.005033 0.40751 8.3004
256 1X14 NAD 0.00007916 0.52337 8.33333
257 1P31 EPU 0.005975 0.43021 8.33333
258 1B4N GUA 0.02516 0.42127 8.33333
259 1QMG APX 0.007352 0.41373 8.33333
260 5DN9 NAD 0.0002643 0.40847 8.33333
261 1GZ6 NAI 0.00456 0.40443 8.33333
262 5MST AMP 0.03565 0.40238 8.33333
263 3GMB FAD 0.000000003944 0.62145 8.51064
264 5JWC FAD 0.00000002963 0.58422 8.51064
265 4X9M FAD 0.00000001336 0.57322 8.51064
266 5J60 FAD 0.00000001364 0.57291 8.51064
267 3CTY FAD 0.000000003674 0.56703 8.51064
268 2WET FAD 0.00000003726 0.55985 8.51064
269 1MV8 NAD 0.00001035 0.52333 8.51064
270 1MUU NAD 0.00001978 0.5161 8.51064
271 3L9W AMP 0.00009733 0.46899 8.51064
272 2G5C NAD 0.0001497 0.46504 8.51064
273 3L9W GSH 0.0002114 0.46243 8.51064
274 3VYW SAM 0.001735 0.44787 8.51064
275 3T7S SAM 0.002746 0.44603 8.51064
276 1E3W NAD 0.0006778 0.4393 8.51064
277 2CVQ NDP 0.0009805 0.43586 8.51064
278 2PXX SAH 0.006546 0.42503 8.51064
279 5JJR SAH 0.008923 0.42203 8.51064
280 1E6W NAD 0.002937 0.4143 8.51064
281 4PIV NDP 0.004858 0.40336 8.52713
282 1GEG NAD 0.005755 0.40281 8.59375
283 2CUL FAD 0.00000001689 0.548 8.62069
284 2CDO GAL AAL GAL AAL GAL AAL 0.04886 0.40226 8.75
285 1E3I CXF 0.0006079 0.42502 8.7766
286 3BGD SAH 0.008161 0.41176 8.84615
287 4OPC PGT 0.0000000367 0.61835 8.86525
288 4OPC FDA 0.00000003031 0.61619 8.86525
289 4FWE FAD 0.00000001045 0.55907 8.86525
290 1GTE FAD 0.000001159 0.43826 8.86525
291 5BUK FAD 0.000000002414 0.60554 8.88889
292 4NTC FAD 0.00000006016 0.54501 8.97436
293 1GPE FAD 0.0000004652 0.49814 8.97436
294 5MZI FAD 0.00000002652 0.4812 8.97436
295 5MZI FYK 0.00000002867 0.47672 8.97436
296 4YMH SAH 0.003174 0.43605 8.97436
297 4BVA NDP 0.000982 0.43021 8.97436
298 4LWP SAH 0.006276 0.4292 8.97436
299 3U31 NAD 0.004834 0.42467 8.97436
300 3NUG NAD 0.003864 0.40721 8.97436
301 1YQZ FAD 0.000000132 0.56291 9.04255
302 5EOW FAD 0.000000005166 0.56082 9.04255
303 1LVL FAD 0.0003568 0.4598 9.04255
304 1D1T NAD 0.0002321 0.45135 9.04255
305 3WLE NAD 0.0001324 0.44873 9.04255
306 1CDO NAD 0.0009387 0.44266 9.04255
307 1U7T NAD 0.002946 0.41944 9.04255
308 5FI3 NAP 0.002789 0.41518 9.04255
309 4XQC 13D 0.0003057 0.41232 9.04255
310 3UOY NAP 0.000002625 0.41138 9.04255
311 3UOY FAD 0.000002625 0.41138 9.04255
312 4XQC NAD 0.0004423 0.41041 9.04255
313 4BV6 FAD 0.00000003265 0.5618 9.21986
314 5KMS FAD 0.0000002788 0.54458 9.21986
315 1MO9 FAD 0.00000006633 0.42351 9.21986
316 5KMS NAD 0.000008723 0.41941 9.21986
317 1MO9 KPC 0.00000008822 0.41926 9.21986
318 1PNO NAP 0.004197 0.40582 9.44444
319 1JQ3 AAT 0.001084 0.42332 9.45946
320 2RGJ FAD 0.00000001639 0.60384 9.57447
321 3AB1 FAD 0.0000000163 0.57029 9.57447
322 1Q1R FAD 0.00000004037 0.57004 9.57447
323 1NYT NAP 0.0002122 0.47291 9.57447
324 3TLJ SAH 0.002866 0.43153 9.57447
325 2PK3 A2R 0.01687 0.40607 9.57447
326 3MMH SME 0.02806 0.41458 9.58084
327 1P77 ATR 0.000002325 0.64567 9.61539
328 2RGO FAD 0.0000000845 0.55872 9.61539
329 5N53 8NB 0.001159 0.50253 9.61539
330 1BW9 NAD 0.0001281 0.49437 9.61539
331 1C1X NAD 0.00008822 0.48498 9.61539
332 5OFW 9TW 0.01158 0.44696 9.61539
333 2I3G NAP 0.0005563 0.43975 9.61539
334 3G2O SAM 0.006314 0.42908 9.61539
335 2FK8 SAM 0.008881 0.41588 9.61539
336 3EC1 GDP 0.02697 0.4119 9.61539
337 4ONQ SFG 0.0151 0.41129 9.61539
338 1US5 GLU 0.02898 0.41029 9.61539
339 3NZK C90 0.02362 0.40211 9.61539
340 4GUT FAD 0.00000001332 0.58323 9.67742
341 4HSU FAD 0.00000001873 0.57497 9.67742
342 4GUS FAD 0.00000001295 0.55079 9.67742
343 1FWV SGA MAG FUC 0.02314 0.43469 9.70149
344 3QV1 NAD 0.00009061 0.40049 9.7561
345 1QAN SAH 0.006579 0.41874 9.83607
346 1YY5 FAD 0.00000001209 0.55071 9.92908
347 2QES ADE 0.02761 0.41933 9.92908
348 1NVM NAD 0.000237 0.40206 9.92908
349 2IVD FAD 0.00000006361 0.56756 10.1064
350 3KLJ FAD 0.000000003444 0.56167 10.1064
351 2YVF FAD 0.000691 0.46229 10.1064
352 2AOT SAH 0.006822 0.4346 10.1064
353 4CQM NAP 0.001607 0.42458 10.1064
354 4N49 SAM 0.006576 0.42178 10.1064
355 4RQU NAD 0.00007214 0.40962 10.1064
356 2YVF NAD 0.02143 0.4032 10.1064
357 1H5Q NAP 0.0009432 0.43089 10.1887
358 3GGO ENO 0.0005282 0.41884 10.1911
359 3GGO NAI 0.0005282 0.41884 10.1911
360 3ZNN FAD 0.00000002119 0.58885 10.2564
361 3ZNN 4WL 0.00000002119 0.58885 10.2564
362 1HYH NAD 0.00002884 0.48939 10.2564
363 2EV9 SKM 0.0001313 0.46077 10.2564
364 2EV9 NAP 0.0001313 0.46077 10.2564
365 2ZIF SAM 0.004869 0.43094 10.2564
366 1TZD ADP 0.03736 0.41665 10.2564
367 1W2D ADP 0.04501 0.4037 10.2564
368 5HJM MTA 0.02092 0.40175 10.2837
369 3KIH GDL 0.04154 0.41297 10.3093
370 4EUE NAI 0.0001546 0.45806 10.5263
371 4YRY FAD 0.0000000628 0.53848 10.6383
372 1N4W FAD 0.000006265 0.48694 10.6383
373 4YRY NAD 0.000000106 0.48351 10.6383
374 2C7G ODP 0.0002636 0.47471 10.6383
375 2C7G FAD 0.0002776 0.47471 10.6383
376 1ELI PYC 0.00001134 0.46831 10.6383
377 3LZW FAD 0.001204 0.43423 10.6383
378 3LZW NAP 0.003203 0.43423 10.6383
379 3GCZ SAM 0.006272 0.42922 10.6383
380 4J4H NAI 0.0002861 0.4333 10.8108
381 4J4H 1J1 0.0002861 0.4333 10.8108
382 4C3Y FAD 0.000000003021 0.59691 10.8974
383 4C3Y ANB 0.00000002586 0.57326 10.8974
384 1UWK URO 0.0002413 0.43481 10.8974
385 1UWK NAD 0.0002413 0.43481 10.8974
386 1I1N SAH 0.005723 0.40773 10.8974
387 4CMI NAP 0.006166 0.40398 10.8974
388 3JQB NAP 0.007138 0.40383 10.8974
389 4CM4 NAP 0.00669 0.40257 10.8974
390 5JCJ NAP 0.006941 0.40193 10.8974
391 5JDC NAP 0.006978 0.40183 10.8974
392 3JQ8 NAP 0.006596 0.40048 10.8974
393 2V3B FAD 0.000000009476 0.56503 10.9091
394 1ZEM NAD 0.000253 0.46612 10.9929
395 3H8V ATP 0.000007804 0.40482 10.9929
396 5VKT NAP 0.002405 0.41771 11.0497
397 5L95 AMP 0.00001512 0.54602 11.1111
398 1NU4 MLA 0.02422 0.41673 11.3402
399 3JV7 NAD 0.0004055 0.44805 11.3475
400 4J56 FAD 0.00000002988 0.568 11.4035
401 5MBX SP5 0.00000005689 0.57105 11.4688
402 5MBX FAD 0.00000005689 0.57105 11.4688
403 5U8U FAD 0.00000005705 0.5817 11.5385
404 1GET NAP 0.00000008618 0.57838 11.5385
405 1GET FAD 0.00000007544 0.57838 11.5385
406 1Y8Q ATP 0.000004547 0.54785 11.5385
407 5EB4 FAD 0.000001242 0.50663 11.5385
408 1F8G NAD 0.0004612 0.46979 11.5385
409 1L7E NAI 0.0009461 0.449 11.5385
410 4RM0 FUC NDG GAL 0.01655 0.43071 11.5385
411 4RM0 FUC NAG GAL 0.01871 0.42651 11.5385
412 4FZV SAM 0.005373 0.42574 11.5385
413 2HK9 ATR 0.000002957 0.62182 11.7021
414 4J36 1HR 0.000000004431 0.59478 11.7021
415 5EVY FAD 0.0000007112 0.588 11.7021
416 1KYQ NAD 0.000003754 0.58653 11.7021
417 4J36 FAD 0.00000000161 0.57107 11.7021
418 3LAD FAD 0.00000001761 0.55675 11.7021
419 2RAB FAD 0.00000002511 0.5407 11.7021
420 2HK9 NAP 0.000148 0.47572 11.7021
421 2RAB NAD 0.0000001092 0.4487 11.7021
422 3GDH SAH 0.001736 0.43775 11.7021
423 4R6W SAH 0.001439 0.42122 11.7021
424 1E6E FAD 0.00000001669 0.55326 11.7188
425 4XDY NAI 0.002144 0.42787 11.8343
426 5ULP KB1 0.00708 0.41168 11.9403
427 1M48 FRG 0.0232 0.42702 12.0301
428 4MOP 2H5 0.0000002397 0.47967 12.1795
429 3EGV SAH 0.001428 0.46342 12.1795
430 2NXE SAM 0.002339 0.44929 12.1795
431 3F8D FAD 0.0000003051 0.42752 12.1795
432 4XZ3 COA 0.008965 0.40998 12.1795
433 4CNK FAD 0.0000000007128 0.60746 12.234
434 3OFK SAH 0.001356 0.44909 12.234
435 2P39 SCR 0.01069 0.44153 12.2581
436 3DMH SAM 0.002587 0.44005 12.5984
437 3DMH GMP 0.005545 0.40829 12.5984
438 2OOR TXP 0.007485 0.40299 12.6437
439 3CGB FAD 0.00000001064 0.59049 12.766
440 3CGD COA 0.0000002268 0.57056 12.766
441 3CGD NAD 0.0000002268 0.57056 12.766
442 3CGD FAD 0.0000002268 0.57056 12.766
443 5G3U FDA 0.0000000179 0.56103 12.766
444 5G3U ITW 0.0000001067 0.54901 12.766
445 5T96 79J 0.04337 0.40831 12.766
446 3G5S FAD 0.00000002489 0.55153 12.8205
447 4QTU SAM 0.00185 0.45025 12.9808
448 5LD5 NAD 0.0004541 0.46627 13.1206
449 2DKH 3HB 0.001345 0.43354 13.1206
450 2DKH FAD 0.00182 0.42153 13.1206
451 2V6G NAP 0.0007989 0.43367 13.2979
452 1WDK NAD 0.00004241 0.51096 13.4615
453 5CAE COA 0.0008224 0.4516 13.4615
454 3L4S NAD 0.001738 0.4181 13.4615
455 3L4S 3PG 0.002367 0.41061 13.4615
456 5CAE SIN 0.004344 0.40072 13.4615
457 5E8J SAH 0.007601 0.43608 13.6364
458 3GF4 FAD 0.000006222 0.43608 13.8298
459 3GF4 UPG 0.000003202 0.43419 13.8298
460 5JE8 NAD 0.0001295 0.48189 14.1026
461 4OOE NDP 0.009545 0.40108 14.1026
462 3WMX NAD 0.001728 0.43174 14.1844
463 5MDH NAD 0.005556 0.40825 14.1844
464 5WGR FAD 0.00000008175 0.54661 14.3617
465 2UZ1 TPP 0.008735 0.40518 14.3617
466 3NYC FAD 0.00000007574 0.49913 14.539
467 3NYC IAR 0.00000007574 0.49913 14.539
468 2FKA BEF 0.00007197 0.58719 14.7287
469 1DJN ADP 0.000000001742 0.7013 14.7436
470 1O94 ADP 0.000000002974 0.51385 14.7436
471 1ZH8 NAP 0.002949 0.41942 14.7436
472 4YMZ 13P 0.04306 0.40829 14.7436
473 1ZMD FAD 0.000000007412 0.58713 14.8936
474 1ZMD NAI 0.0000007346 0.45464 14.8936
475 3DXY SAM 0.003611 0.45656 15.1376
476 4OBW SAM 0.003307 0.44224 15.1751
477 1EQ2 NAP 0.005995 0.40447 15.2482
478 2JJQ SAH 0.006647 0.43899 15.3846
479 5TVA AMP 0.03224 0.41139 15.3846
480 5GUD NDP 0.001964 0.40042 15.3846
481 5JCA NDP 0.00000007469 0.5741 15.4255
482 5JCM FAD 0.0000001159 0.56945 15.4255
483 5JCM NAD 0.0000001241 0.56945 15.4255
484 5JCM ISD 0.0000001241 0.56945 15.4255
485 5JCA FAD 0.0000000234 0.56839 15.4255
486 3GJ0 GDP 0.03515 0.40941 15.4255
487 2YVJ FAD 0.00000009652 0.5326 15.5963
488 2YVJ NAI 0.0000005407 0.42289 15.5963
489 2HQM FAD 0.00000001667 0.57342 15.6028
490 3QFA FAD 0.00000003297 0.56332 15.9574
491 1H82 FAD 0.000000009962 0.50645 15.9574
492 1H82 GZZ 0.00000001475 0.48328 15.9574
493 2VDV SAM 0.001404 0.47263 15.9574
494 4KRI SAH 0.001249 0.4543 15.9574
495 5BVA FAD 0.000000003958 0.56574 16.0256
496 2A92 NAI 0.000361 0.40158 16.0256
497 1FL2 FAD 0.00000004155 0.56079 16.4516
498 3VPH OXM 0.00008963 0.42836 16.4894
499 3VPH NAD 0.00009955 0.42125 16.4894
500 2QA1 FAD 0.0000165 0.49974 16.6667
501 1J49 NAD 0.0001355 0.47014 16.6667
502 3GFB NAD 0.0006032 0.44737 16.6667
503 2YYY NAP 0.001485 0.42867 16.6667
504 5C2N NAG 0.02412 0.42828 16.6667
505 3WV8 ATP 0.00001088 0.40873 16.6667
506 1ZVW PRP 0.01852 0.4071 16.9312
507 2IID FAD 0.00000008648 0.48695 17.0213
508 2IID PHE 0.00000008648 0.48695 17.0213
509 1Z82 NDP 0.007362 0.40328 17.0213
510 3NKS FAD 0.0000002548 0.5199 17.3077
511 5HSA FAS 0.0000009582 0.50566 17.3077
512 1VE3 SAM 0.00597 0.43022 17.3077
513 4DD8 BAT 0.03303 0.41852 17.7885
514 5ODQ FAD 0.00000002978 0.54935 17.9348
515 3AD8 NAD 0.000000007941 0.61024 17.9487
516 1XXA ARG 0.008067 0.45225 17.9487
517 3AD8 FAD 0.0000004682 0.4319 17.9487
518 3AD8 PYC 0.0000004682 0.4319 17.9487
519 3Q9T FAY 0.002244 0.42408 17.9487
520 2GAG NAD 0.00000001374 0.58656 18.1818
521 2GAG FAD 0.0000001098 0.51542 18.1818
522 2GAG FOA 0.0000001967 0.50737 18.1818
523 2DPM SAM 0.00552 0.42212 18.5897
524 3WE0 FAD 0.00009057 0.48256 18.617
525 2F5Z FAD 0.00000000763 0.5867 18.75
526 2BRY FAD 0.0000000104 0.61123 19.1489
527 4YNU LGC 0.0000007636 0.525 19.1489
528 4YNU FAD 0.0000005377 0.52487 19.1489
529 1L1E SAH 0.01119 0.41133 19.2308
530 1LDN NAD 0.00004725 0.42378 19.6809
531 2AHR NAP 0.003706 0.40792 19.8718
532 3AYI HCI 0.00000001885 0.58668 20.5128
533 3AYI FAD 0.00000001723 0.58668 20.5128
534 2X3N FAD 0.00000004558 0.56818 20.5128
535 2GV8 FAD 0.0000001769 0.56052 20.5128
536 1VQW FAD 0.00000008992 0.51658 20.5128
537 2GVC FAD 0.0000001023 0.51487 20.5128
538 2GV8 NDP 0.0007576 0.45312 20.5128
539 5FJN BE2 0.00000003337 0.56791 20.7447
540 5FJN FAD 0.00000002561 0.56706 20.7447
541 2F1K NAP 0.00001829 0.41937 20.7447
542 4GNI ATP 0.03077 0.40248 20.7447
543 4NEC SAH 0.01042 0.4256 21.2766
544 2DBZ NAP 0.0008415 0.43851 21.7949
545 4XYB NDP 0.0006483 0.42905 21.7949
546 4CJX NAP 0.0005009 0.45728 21.8085
547 5MGZ SAH 0.008771 0.41918 21.8085
548 2VVM FAD 0.00000006217 0.55063 21.9858
549 2VVL FAD 0.0000000655 0.54409 21.9858
550 1VM6 NAD 0.002161 0.43066 22.3404
551 5TS5 FAD 0.00000001993 0.56121 22.8723
552 1LUA NAP 0.002057 0.44454 23.0769
553 2I7C AAT 0.0008995 0.42381 24.359
554 2XOD FMN 0.0213 0.40138 24.3697
555 3ABI NAD 0.0001368 0.40773 25
556 2GMH FAD 0.000000007995 0.57428 26.9231
557 3RNM FAD 0.000000009753 0.55892 29.3103
558 1QO8 FAD 0.00000000000002554 0.77171 32.1555
559 2BOS GLA GAL GLC 0.04072 0.41263 32.3529
560 2BOS GLA GAL GLC NBU 0.04364 0.41038 32.3529
561 1D4D FAD 0.00000000000002165 0.77656 33.3916
562 1Q9I TEO 0.0000000000001086 0.62925 34.8511
563 1Q9I FAD 0.0000000000001086 0.62925 34.8511
564 1JNR FAD 0.00000005826 0.58966 35.969
565 5FA5 MTA 0.004951 0.44139 40
566 2BS3 CIT 0.004257 0.4446 47.7519
567 1KNR FAD 0.000000000000002998 0.79829 49.6296
Pocket No.: 3; Query (leader) PDB : 4YSX; Ligand: MLI; Similar sites found: 26
This union binding pocket(no: 3) in the query (biounit: 4ysx.bio2) has 12 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 5IXJ THR 0.03924 0.4048 3.20513
2 1SQK ADP 0.009221 0.41731 3.5461
3 4DV8 0LX 0.04923 0.40052 3.7234
4 2A8Y MTA 0.016 0.41235 4.48718
5 2WQQ CSF 0.02816 0.40024 6.18557
6 4UP3 FAD 0.04875 0.4076 6.38298
7 3MN9 ATP 0.004949 0.44036 6.41026
8 2PW0 TRC 0.01137 0.40269 6.73759
9 2PZM NAD 0.0483 0.41216 6.91489
10 2PZM UDP 0.0483 0.41216 6.91489
11 1YNH SUO 0.0133 0.42206 7.05128
12 4PKI ATP 0.009946 0.42149 7.40741
13 2A42 ATP 0.005775 0.43616 9.61539
14 3KJS NAP 0.01322 0.42917 9.61539
15 4GLL NAD 0.03506 0.40986 9.92908
16 3NCQ ATP 0.04689 0.4126 12.1795
17 2A40 ATP 0.005862 0.43602 12.5
18 1RM6 FAD 0.01125 0.44386 12.8205
19 2WME NAP 0.009632 0.42351 14.1026
20 4EFH ADP 0.006787 0.42788 15.9574
21 2A92 NAI 0.02588 0.41681 16.0256
22 2WK9 PLG 0.02227 0.41842 18.5897
23 4B1W ATP 0.00967 0.42577 28.125
24 1D4D SIN 0.000000001892 0.74461 33.3916
25 1D4D FAD 0.004633 0.47479 33.3916
26 2BS3 CIT 0.000003113 0.48287 47.7519
Pocket No.: 4; Query (leader) PDB : 4YSX; Ligand: EPH; Similar sites found: 7
This union binding pocket(no: 4) in the query (biounit: 4ysx.bio2) has 23 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 5UGW GSH 0.005759 0.40861 6.28571
2 3SHZ 5CO 0.01741 0.40363 7.80142
3 2VWA PTY 0.006439 0.44319 8.91089
4 4I4B NAD 0.03332 0.40171 10.1064
5 3KDU NKS 0.01301 0.40545 10.1083
6 4WGF HX2 0.02262 0.40207 15.4255
7 1PU7 39A 0.004965 0.4252 18.3486
Pocket No.: 5; Query (leader) PDB : 4YSX; Ligand: MLI; Similar sites found: 17
This union binding pocket(no: 5) in the query (biounit: 4ysx.bio1) has 13 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 2V51 ATP 0.01674 0.41384 3.5461
2 1GKZ ADP 0.02552 0.40129 5.67376
3 4HA6 FAD 0.04514 0.41389 5.76923
4 4KXQ APR 0.02652 0.40483 6.91489
5 1T44 ATP 0.01718 0.41113 7.48299
6 5DN9 NAD 0.03958 0.40756 8.33333
7 1YAG ATP 0.01232 0.4246 8.8
8 5BUK FAD 0.04422 0.41533 8.88889
9 4I54 1C1 0.01383 0.43011 10.2564
10 2VZZ SCA 0.04726 0.40064 10.2564
11 3CMC NAD 0.04818 0.42562 10.7784
12 1LRW PQQ 0.01982 0.40862 10.8434
13 3G5S FAD 0.04862 0.40709 12.8205
14 4LNU GTP 0.02739 0.41084 13.4615
15 3RSC TYD 0.02331 0.4066 16.4894
16 2Q97 ATP 0.01523 0.41735 20.155
17 3ABI NAD 0.04654 0.40027 25
Pocket No.: 6; Query (leader) PDB : 4YSX; Ligand: EPH; Similar sites found: 3
This union binding pocket(no: 6) in the query (biounit: 4ysx.bio1) has 22 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 3WCA FPS 0.006842 0.41161 4.25532
2 2JFZ 003 0.03512 0.40315 4.25532
3 4V24 GYR 0.01299 0.40177 12.8205
Pocket No.: 7; Query (leader) PDB : 4YSX; Ligand: FAD; Similar sites found: 35
This union binding pocket(no: 7) in the query (biounit: 4ysx.bio1) has 42 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 3HVJ 705 0.002743 0.40049 4.97738
2 1M2W NAD 0.01424 0.40213 5.12821
3 4IJ6 SEP 0.02176 0.43126 5.21327
4 2GJP MAL 0.01785 0.4171 5.76923
5 4UP4 NDG 0.04672 0.40674 5.76923
6 4XFR CIT 0.01751 0.43428 5.85106
7 1YKF NAP 0.004329 0.40867 6.38298
8 1XKQ NDP 0.004516 0.40108 7.05128
9 3EVG SAH 0.01009 0.42046 7.69231
10 3T1O GDP 0.009366 0.4325 7.97872
11 3EWP APR 0.01146 0.40365 8.33333
12 5MSD AMP 0.0343 0.40101 8.97436
13 1XXR MAN 0.01431 0.43274 9.31677
14 5AOA PPI 0.03746 0.41244 9.61539
15 5TE1 7A2 0.03807 0.41207 9.61539
16 2HT6 GDP 0.0218 0.42519 9.77011
17 3QIN P1Y 0.04475 0.40478 10
18 2FLI DX5 0.0184 0.40246 10
19 2ZFI ADP 0.02119 0.4219 10.1064
20 4USI AKG 0.04497 0.40799 10.3896
21 4CM8 NAP 0.007165 0.40234 10.8974
22 3JQG NAP 0.008417 0.40187 10.8974
23 4NBT NAD 0.007608 0.40129 10.8974
24 3BMN NAP 0.00687 0.40075 10.8974
25 2ZAT NAP 0.006705 0.40117 11.1538
26 5X62 SAH 0.02766 0.40262 11.5385
27 4TO8 FLC 0.01792 0.42033 12.1795
28 2D24 XYS XYS 0.03402 0.41909 12.1795
29 5THY SAH 0.02058 0.40024 12.1795
30 4ZNO SUC 0.02728 0.41997 13.4615
31 4FMS BDP 0.04378 0.41255 14.3617
32 3GJ8 GDP 0.04452 0.40148 15.4255
33 4F8L AES 0.02067 0.424 15.8621
34 4WOP CTP 0.03557 0.40022 17.3333
35 5F5N NAD 0.01015 0.40092 18.0851
Pocket No.: 8; Query (leader) PDB : 4YSX; Ligand: E23; Similar sites found: 20
This union binding pocket(no: 8) in the query (biounit: 4ysx.bio1) has 14 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 2V51 ATP 0.02898 0.40055 3.5461
2 5BZ4 COA 0.02427 0.40292 4.48718
3 3RIY NAD 0.04314 0.40213 4.48718
4 2WZV FMN 0.0494 0.40419 5.12821
5 3SLS 77D 0.0211 0.4025 5.31915
6 1OW4 2AN 0.003751 0.40405 5.42636
7 5UI2 EQ3 0.0455 0.40414 5.76923
8 4CL6 7SB 0.004531 0.44216 8.33333
9 5EW9 5VC 0.04908 0.43658 8.48709
10 1YAG ATP 0.02877 0.40377 8.8
11 2XMY CDK 0.04575 0.42409 10.0671
12 4YV5 SVR 0.01791 0.46797 10.6557
13 4JNE ATP 0.02416 0.4092 10.8974
14 5OCA 9QZ 0.0087 0.43464 11.1111
15 5B4B LP5 0.04461 0.40018 11.6935
16 2CK3 ANP 0.01942 0.40617 13.6986
17 1NZY BCA 0.03465 0.40487 14.1264
18 3U4L ATP 0.0273 0.40191 15
19 4BXK 1IU 0.01996 0.42677 17.3077
20 1P0H ACO 0.007083 0.47126 19.6809
Feedback