Receptor
PDB id Resolution Class Description Source Keywords
1D1S 2.5 Å EC: 1.1.1.1 WILD-TYPE HUMAN SIGMA (CLASS IV) ALCOHOL DEHYDROGENASE HOMO SAPIENS ROSSMAN OR DINUCLEOTIDE FOLD OXIDOREDUCTASE
Ref.: METHIONINE-141 DIRECTLY INFLUENCES THE BINDING OF 4-METHYLPYRAZOLE IN HUMAN SIGMA SIGMA ALCOHOL DEHYD PROTEIN SCI. V. 8 2639 1999
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
ACT A:501;
A:502;
A:504;
A:513;
B:506;
B:507;
C:505;
C:510;
D:508;
D:509;
D:511;
D:512;
D:514;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
submit data
59.044 C2 H3 O2 CC(=O...
CAC A:554;
B:551;
B:552;
B:553;
B:555;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
none;
none;
none;
none;
none;
submit data
136.989 C2 H6 As O2 C[As]...
NAD A:1377;
B:2377;
C:3377;
D:4377;
Valid;
Valid;
Valid;
Valid;
none;
none;
none;
none;
submit data
663.425 C21 H27 N7 O14 P2 c1cc(...
ZN A:375;
A:376;
A:401;
A:402;
A:403;
A:408;
B:375;
B:376;
B:404;
B:405;
B:406;
C:375;
C:376;
C:407;
D:375;
D:376;
D:409;
D:410;
D:411;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
submit data
65.409 Zn [Zn+2...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1D1T 2.4 Å EC: 1.1.1.1 MUTANT OF HUMAN SIGMA ALCOHOL DEHYDROGENASE WITH LEUCINE AT 141 HOMO SAPIENS ROSSMANN OR DINUCLEOTIDE FOLD OXIDOREDUCTASE
Ref.: METHIONINE-141 DIRECTLY INFLUENCES THE BINDING OF 4-METHYLPYRAZOLE IN HUMAN SIGMA SIGMA ALCOHOL DEHYD PROTEIN SCI. V. 8 2639 1999
Members (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 19 families.
1 1D1T - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
2 1D1S - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
70% Homology Family (62)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 11 families.
1 1E3I - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
2 1E3L - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
3 1E3E - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
4 1JU9 Ki = 1640 uM NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
5 5VN1 Ki = 5.4 uM NWH C8 H17 N O CCCCC[C@H]....
6 2JHG - NAD IBO n/a n/a
7 1P1R Ki = 15 uM NMH C8 H17 N O CCCCC[C@@H....
8 1MG0 - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
9 2JHF Kd = 5 nM NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
10 1N8K - NAJ PZO n/a n/a
11 1QLH - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
12 3OQ6 - NAJ C21 H27 N7 O14 P2 c1cc(c[n+]....
13 3BTO Ki = 0.72 uM SSB C8 H16 O S CCCC[C@H]1....
14 4NFH - PFB C7 H3 F5 O C(c1c(c(c(....
15 5VL0 Ki = 0.74 uM BNF C8 H9 N O c1ccc(cc1)....
16 1BTO Ki = 0.31 uM SSB C8 H16 O S CCCC[C@H]1....
17 1LDE - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
18 1N92 Ki = 0.02 uM NAJ PYZ n/a n/a
19 1QV7 - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
20 4DWV Ki = 0.52 uM PFB C7 H3 F5 O C(c1c(c(c(....
21 1MGO Ki = 51 uM PFB C7 H3 F5 O C(c1c(c(c(....
22 1LDY - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
23 1HLD - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
24 1HET - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
25 1HEU - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
26 1AXG - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
27 5KCZ Kd = 15 uM NAJ C21 H27 N7 O14 P2 c1cc(c[n+]....
28 5KCP Ki = 740 uM PFB C7 H3 F5 O C(c1c(c(c(....
29 4NFS - ETF C2 H3 F3 O C(C(F)(F)F....
30 4NG5 Ki = 1.9 uM PFB C7 H3 F5 O C(c1c(c(c(....
31 1QV6 - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
32 5VKR Ki = 41 uM APR C15 H23 N5 O14 P2 c1nc(c2c(n....
33 1EE2 - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
34 1A71 - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
35 4DXH Ki = 8.4 uM ETF C2 H3 F3 O C(C(F)(F)F....
36 2OHX - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
37 5VJG Kd = 0.31 mM 0BP C10 H8 N2 c1ccnc(c1)....
38 1AXE - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
39 2OXI - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
40 1HF3 - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
41 1D1T - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
42 1D1S - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
43 1CDO - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
44 1MP0 - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
45 2FZE - APR C15 H23 N5 O14 P2 c1nc(c2c(n....
46 2FZW Kd = 0.076 uM NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
47 1M6W - 12H C12 H24 O3 C(CCCCCC(=....
48 1MA0 - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
49 1U3T Ki = 0.36 uM CCB C10 H17 N O C1CCC(C1)N....
50 1U3V Ki = 0.33 uM HPL C8 H17 N O CCCCCCCNC=....
51 1HDY - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
52 1HSZ - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
53 1U3W Ki = 0.41 uM FXY C9 H19 N O CCCCCC[C@@....
54 1HDZ - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
55 1HT0 - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
56 1U3U Ki = 0.33 uM BNF C8 H9 N O c1ccc(cc1)....
57 1HDX - CXL C6 H12 O C1CCC(CC1)....
58 1HTB Kd = 670 uM NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
59 1HSO - PYZ C3 H3 I N2 c1c(cn[nH]....
60 1DEH Kd = 1.9 uM NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
61 4RQU Kd = 1.6 mM NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
62 1P0F - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
50% Homology Family (63)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 8 families.
1 1E3I - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
2 1E3L - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
3 1E3E - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
4 1JU9 Ki = 1640 uM NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
5 5VN1 Ki = 5.4 uM NWH C8 H17 N O CCCCC[C@H]....
6 2JHG - NAD IBO n/a n/a
7 1P1R Ki = 15 uM NMH C8 H17 N O CCCCC[C@@H....
8 1MG0 - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
9 2JHF Kd = 5 nM NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
10 1N8K - NAJ PZO n/a n/a
11 1QLH - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
12 3OQ6 - NAJ C21 H27 N7 O14 P2 c1cc(c[n+]....
13 3BTO Ki = 0.72 uM SSB C8 H16 O S CCCC[C@H]1....
14 4NFH - PFB C7 H3 F5 O C(c1c(c(c(....
15 5VL0 Ki = 0.74 uM BNF C8 H9 N O c1ccc(cc1)....
16 1BTO Ki = 0.31 uM SSB C8 H16 O S CCCC[C@H]1....
17 1LDE - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
18 1N92 Ki = 0.02 uM NAJ PYZ n/a n/a
19 1QV7 - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
20 4DWV Ki = 0.52 uM PFB C7 H3 F5 O C(c1c(c(c(....
21 1MGO Ki = 51 uM PFB C7 H3 F5 O C(c1c(c(c(....
22 1LDY - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
23 1HLD - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
24 1HET - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
25 1HEU - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
26 1AXG - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
27 5KCZ Kd = 15 uM NAJ C21 H27 N7 O14 P2 c1cc(c[n+]....
28 5KCP Ki = 740 uM PFB C7 H3 F5 O C(c1c(c(c(....
29 4NFS - ETF C2 H3 F3 O C(C(F)(F)F....
30 4NG5 Ki = 1.9 uM PFB C7 H3 F5 O C(c1c(c(c(....
31 1QV6 - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
32 5VKR Ki = 41 uM APR C15 H23 N5 O14 P2 c1nc(c2c(n....
33 1EE2 - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
34 1A71 - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
35 4DXH Ki = 8.4 uM ETF C2 H3 F3 O C(C(F)(F)F....
36 2OHX - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
37 5VJG Kd = 0.31 mM 0BP C10 H8 N2 c1ccnc(c1)....
38 1AXE - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
39 2OXI - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
40 1HF3 - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
41 1D1T - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
42 1D1S - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
43 1CDO - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
44 1MP0 - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
45 2FZE - APR C15 H23 N5 O14 P2 c1nc(c2c(n....
46 2FZW Kd = 0.076 uM NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
47 1M6W - 12H C12 H24 O3 C(CCCCCC(=....
48 1MA0 - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
49 1U3T Ki = 0.36 uM CCB C10 H17 N O C1CCC(C1)N....
50 1U3V Ki = 0.33 uM HPL C8 H17 N O CCCCCCCNC=....
51 1HDY - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
52 1HSZ - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
53 1U3W Ki = 0.41 uM FXY C9 H19 N O CCCCCC[C@@....
54 1HDZ - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
55 1HT0 - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
56 1U3U Ki = 0.33 uM BNF C8 H9 N O c1ccc(cc1)....
57 1HDX - CXL C6 H12 O C1CCC(CC1)....
58 1HTB Kd = 670 uM NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
59 1HSO - PYZ C3 H3 I N2 c1c(cn[nH]....
60 1DEH Kd = 1.9 uM NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
61 1F8F - NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
62 4RQU Kd = 1.6 mM NAD C21 H27 N7 O14 P2 c1cc(c[n+]....
63 1P0F - NAP C21 H28 N7 O17 P3 c1cc(c[n+]....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: NAD; Similar ligands found: 220
No: Ligand ECFP6 Tc MDL keys Tc
1 A3D 0.872727 0.986111
2 NAD IBO 0.845455 0.933333
3 NHD 0.821429 0.972222
4 NAP 0.811966 0.986111
5 NAJ PYZ 0.803419 0.910256
6 NFD 0.791304 0.946667
7 NXX 0.765766 0.972603
8 DND 0.765766 0.972603
9 ZID 0.737705 0.986111
10 NAQ 0.729508 0.934211
11 NAE 0.721311 0.959459
12 NA0 0.712 0.972603
13 TAP 0.704 0.921053
14 AMP NAD 0.696 0.945946
15 NDE 0.689922 0.972603
16 NAJ 0.683333 0.972222
17 NDC 0.679389 0.934211
18 NDO 0.674603 0.958904
19 N01 0.656 0.972222
20 CNA 0.642276 0.972603
21 NBP 0.621212 0.922078
22 NAD BBN 0.609929 0.876543
23 8ID 0.609756 0.922078
24 NAD CJ3 0.601399 0.845238
25 ADP MG 0.579439 0.918919
26 A2D 0.576923 0.958333
27 ADP 0.575472 0.931507
28 NGD 0.574803 0.922078
29 BEF ADP 0.574074 0.894737
30 ADP BEF 0.574074 0.894737
31 BA3 0.566038 0.958333
32 NAD NDT 0.565789 0.755319
33 M33 0.564815 0.918919
34 ADP PO3 0.563636 0.957747
35 B4P 0.560748 0.958333
36 AP5 0.560748 0.958333
37 ATP MG 0.558559 0.918919
38 AN2 0.555556 0.918919
39 GAP 0.553571 0.932432
40 OOB 0.551724 0.972222
41 CA0 0.550459 0.932432
42 ATP 0.545455 0.931507
43 ACP 0.545455 0.906667
44 NAD TDB 0.544872 0.70297
45 ADP ALF 0.54386 0.883117
46 ALF ADP 0.54386 0.883117
47 5FA 0.540541 0.931507
48 AQP 0.540541 0.931507
49 APR 0.540541 0.931507
50 AR6 0.540541 0.931507
51 ANP MG 0.53913 0.907895
52 VO4 ADP 0.53913 0.945205
53 ADP VO4 0.53913 0.945205
54 AGS 0.535714 0.883117
55 SAP 0.535714 0.883117
56 AD9 0.535714 0.906667
57 WAQ 0.533333 0.896104
58 ABM 0.53271 0.905405
59 00A 0.529412 0.921053
60 DLL 0.529412 0.972222
61 ANP 0.526316 0.906667
62 NJP 0.526316 0.959459
63 ACQ 0.526316 0.906667
64 OAD 0.525 0.932432
65 AMP MG 0.523364 0.905405
66 ADX 0.522523 0.839506
67 5AL 0.521739 0.945205
68 A1R 0.521008 0.871795
69 9SN 0.520325 0.909091
70 AMP 0.518868 0.930556
71 A 0.518868 0.930556
72 50T 0.517857 0.893333
73 ATF 0.517241 0.894737
74 DAL AMP 0.516949 0.945205
75 3OD 0.516393 0.932432
76 1ZZ 0.516393 0.851852
77 SON 0.513514 0.92
78 PRX 0.513274 0.881579
79 SRP 0.512821 0.92
80 ADP BMA 0.512397 0.932432
81 3UK 0.512397 0.958904
82 MYR AMP 0.512195 0.851852
83 NAJ PZO 0.510949 0.909091
84 NMN 0.509434 0.875
85 AMP DBH 0.507937 0.906667
86 A22 0.504202 0.945205
87 FA5 0.504 0.945946
88 ATP A A A 0.504 0.971831
89 TYR AMP 0.5 0.945946
90 8QN 0.5 0.945205
91 NAX 0.496183 0.886076
92 PR8 0.495935 0.8625
93 PAJ 0.495868 0.873418
94 4AD 0.495868 0.933333
95 AMO 0.495868 0.92
96 ADQ 0.495868 0.932432
97 A12 0.495495 0.894737
98 AP2 0.495495 0.894737
99 ALF ADP 3PG 0.492424 0.873418
100 LA8 ALF 3PG 0.492424 0.873418
101 AHZ 0.492308 0.851852
102 YAP 0.492063 0.933333
103 FYA 0.491935 0.918919
104 AHX 0.491803 0.884615
105 4UU 0.488372 0.933333
106 5SV 0.487603 0.8375
107 TAT 0.487179 0.894737
108 APC 0.486957 0.894737
109 SRA 0.486239 0.881579
110 NAI 0.484848 0.921053
111 6V0 0.484848 0.909091
112 GTA 0.484615 0.898734
113 A A 0.483871 0.958333
114 LAD 0.483871 0.873418
115 AU1 0.482456 0.906667
116 TXE 0.481203 0.921053
117 AF3 ADP 3PG 0.481203 0.873418
118 OMR 0.481203 0.841463
119 LAQ 0.480916 0.851852
120 G3A 0.48062 0.909091
121 TXA 0.48 0.92
122 NB8 0.48 0.884615
123 ME8 0.48 0.851852
124 BIS 0.48 0.871795
125 PTJ 0.48 0.884615
126 139 0.477941 0.886076
127 LPA AMP 0.477273 0.851852
128 AR6 AR6 0.476923 0.958333
129 G5P 0.476923 0.909091
130 AFH 0.476923 0.873418
131 25L 0.47619 0.945205
132 25A 0.47541 0.958333
133 DZD 0.47482 0.897436
134 TXD 0.473684 0.921053
135 4UV 0.472868 0.933333
136 TYM 0.470149 0.945946
137 ADV 0.470085 0.894737
138 RBY 0.470085 0.894737
139 ARG AMP 0.469697 0.841463
140 4TA 0.467626 0.864198
141 48N 0.466165 0.884615
142 XAH 0.465116 0.851852
143 4UW 0.462687 0.897436
144 M24 0.461538 0.886076
145 IOT 0.459854 0.821429
146 T5A 0.456522 0.853659
147 EAD 0.455782 0.886076
148 MAP 0.455285 0.883117
149 BT5 0.453901 0.821429
150 A4P 0.452555 0.833333
151 UP5 0.451852 0.933333
152 PAP 0.445378 0.917808
153 AP0 0.445255 0.884615
154 4TC 0.445255 0.909091
155 YLP 0.444444 0.831325
156 P1H 0.443709 0.864198
157 AOC 0.442478 0.810811
158 Z5A 0.439189 0.833333
159 2A5 0.436975 0.857143
160 G A A A 0.43662 0.909091
161 COD 0.43662 0.802326
162 ADJ 0.435714 0.841463
163 YLC 0.434783 0.851852
164 YLB 0.434783 0.831325
165 U A G G 0.433566 0.921053
166 ATR 0.433333 0.90411
167 7MD 0.432836 0.851852
168 G5A 0.429752 0.790698
169 PO4 PO4 A A A A PO4 0.429688 0.943662
170 TAD 0.42963 0.873418
171 5AS 0.42735 0.770115
172 BTX 0.426573 0.831325
173 YLA 0.425532 0.831325
174 DSZ 0.425197 0.790698
175 NCN 0.424779 0.805556
176 UPA 0.42446 0.921053
177 VMS 0.424 0.8
178 54H 0.424 0.8
179 N0B 0.422819 0.853659
180 6AD 0.422764 0.85
181 AYB 0.422535 0.821429
182 7D3 0.422414 0.844156
183 YLY 0.421769 0.821429
184 TSB 0.420635 0.809524
185 ODP 0.41958 0.922078
186 AV2 0.419355 0.855263
187 FB0 0.419355 0.775281
188 A5A 0.419355 0.819277
189 NNR 0.419048 0.739726
190 A A A 0.418605 0.918919
191 LEU LMS 0.418605 0.793103
192 649 0.417266 0.775281
193 NMN AMP PO4 0.416667 0.933333
194 SSA 0.416 0.790698
195 P5A 0.415385 0.755556
196 LSS 0.414062 0.772727
197 A2R 0.412698 0.918919
198 52H 0.412698 0.790698
199 JB6 0.412214 0.896104
200 5N5 0.411215 0.783784
201 YSA 0.410448 0.811765
202 5CA 0.409449 0.790698
203 53H 0.409449 0.790698
204 ITT 0.408333 0.878378
205 7D4 0.408333 0.844156
206 NA7 0.407692 0.894737
207 5CD 0.407407 0.794521
208 0WD 0.406897 0.909091
209 A3P 0.40678 0.930556
210 AVV 0.40625 0.860759
211 RAB 0.40566 0.808219
212 ADN 0.40566 0.808219
213 XYA 0.40566 0.808219
214 FDA 0.405063 0.823529
215 GSU 0.40458 0.790698
216 7MC 0.404255 0.831325
217 NSS 0.403101 0.811765
218 6FA 0.402516 0.853659
219 NVA LMS 0.4 0.793103
220 PPS 0.4 0.817073
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 1D1T; Ligand: NAD; 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: 1d1t.bio1) has 32 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 1D1T; Ligand: NAD; Similar sites found: 650
This union binding pocket(no: 2) in the query (biounit: 1d1t.bio1) has 33 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 1UO5 PIH 0.02088 0.41479 None
2 5T2U NAP 0.001525 0.41203 1.20968
3 4NBT NAD 0.002572 0.4099 1.25
4 2DC1 NAD 0.00001864 0.46485 1.27119
5 2XVE FAD 0.0006747 0.45045 1.34048
6 4XYB NDP 0.00006952 0.45006 1.34048
7 2XVF FAD 0.0002231 0.4483 1.34048
8 1DLJ NAI 0.000008855 0.41572 1.34048
9 1DLJ UGA 0.000008855 0.41572 1.34048
10 1MXG ACR 0.03672 0.40426 1.34048
11 4YCA NDP 0.00004478 0.48567 1.36054
12 5BSH PRO 0.001085 0.41616 1.44404
13 5T9E NAP 0.0001846 0.42876 1.47601
14 1OMO NAD 0.0000001988 0.51677 1.5528
15 4RSL FAD 0.0004089 0.43716 1.60858
16 5MZI FAD 0.001427 0.43664 1.60858
17 5MZI FYK 0.00149 0.43664 1.60858
18 1RSG FAD 0.0008859 0.43139 1.60858
19 1YY5 FAD 0.001183 0.4286 1.60858
20 3NTD FAD 0.001751 0.4158 1.60858
21 3NT6 FAD 0.002573 0.40948 1.60858
22 2V6G NAP 0.0008981 0.41603 1.64835
23 4KQW NAP 0.00084 0.42292 1.71429
24 1EK6 UPG 0.007308 0.40608 1.72414
25 4L8V NAP 0.00003639 0.46245 1.78042
26 3WXB NDP 0.002402 0.40591 1.79211
27 2Q1W NAD 0.0008524 0.42002 1.8018
28 1B8U OAA 0.00009995 0.45426 1.82371
29 1B8U NAD 0.000005361 0.45387 1.82371
30 1SOW NAD 0.000001102 0.52624 1.82927
31 5T9F TYR 0.00008441 0.46417 1.84502
32 5T9F NAP 0.0001111 0.45833 1.84502
33 1PN0 FAD 0.0006153 0.44253 1.87668
34 1PN0 IPH 0.000678 0.44184 1.87668
35 4OOE NDP 0.0007603 0.43652 1.87668
36 5MBX SP5 0.001652 0.43098 1.87668
37 5MBX FAD 0.001652 0.43098 1.87668
38 2E5V FAD 0.001431 0.42442 1.87668
39 2D2I NAP 0.0002776 0.41509 1.87668
40 1Z45 NAD 0.001626 0.41488 1.87668
41 1UP7 NAD 0.0003304 0.41411 1.87668
42 5J7X FAD 0.002336 0.41106 1.87668
43 3IHG FAD 0.001213 0.40503 1.87668
44 2J5V PCA 0.04349 0.42008 1.90736
45 1HYE NAP 0.00005816 0.43039 1.91693
46 3VPH OXM 0.0000006336 0.51351 1.93548
47 3VPH NAD 0.000002266 0.50776 1.93548
48 2ZB4 5OP 0.00004515 0.47575 1.96078
49 2ZB4 NAP 0.00004235 0.47543 1.96078
50 1BXK NAD 0.0008211 0.41113 1.97183
51 2ZB3 NDP 0.00004124 0.45777 1.983
52 2I3G NAP 0.0000203 0.4834 1.98864
53 5U5G NAP 0.000002076 0.50288 2.0339
54 3B20 NAD 0.00009404 0.42995 2.0649
55 2BKX F6R 0.01512 0.41287 2.06612
56 3V1Y NAD 0.000005399 0.52237 2.07715
57 1RM4 NDP 0.00006735 0.44642 2.07715
58 3L4S NAD 0.00008834 0.45623 2.08333
59 3L4S 3PG 0.00009714 0.45623 2.08333
60 4KOA NDP 0.0003491 0.48229 2.1021
61 2GLX NDP 0.0005548 0.40349 2.10843
62 1RP0 AHZ 0.0002493 0.43966 2.11268
63 2VYN NAD 0.000006137 0.48617 2.1148
64 1GAD NAD 0.00001678 0.46268 2.12121
65 2HJR APR 0.000002069 0.55476 2.13415
66 1E5Q NDP 0.000005943 0.51173 2.14477
67 4XQC NAD 0.00001364 0.50209 2.14477
68 4XQC 13D 0.00002777 0.49144 2.14477
69 2GSD NAD 0.00007681 0.46293 2.14477
70 2NAD NAD 0.00007956 0.46236 2.14477
71 3KLJ FAD 0.0001597 0.44826 2.14477
72 4KP7 NAP 0.0005862 0.44335 2.14477
73 4KP7 1UQ 0.0005335 0.44089 2.14477
74 3WQQ IB3 0.0005133 0.43937 2.14477
75 1P31 EPU 0.002719 0.43701 2.14477
76 4MOP 2H5 0.00115 0.43552 2.14477
77 1RYI FAD 0.001086 0.42695 2.14477
78 2R4J 13P 0.002311 0.42357 2.14477
79 3A06 FOM 0.00116 0.4202 2.14477
80 5EZ7 FAD 0.001443 0.42008 2.14477
81 3A06 NDP 0.001124 0.41822 2.14477
82 1DLL LAT 0.03961 0.40641 2.14477
83 1P3D UMA 0.005884 0.40097 2.14477
84 4O0L NDP 0.000304 0.43948 2.18182
85 1N1G BCP 0.0004673 0.4337 2.18579
86 1LTH NAD 0.0000006063 0.49771 2.19436
87 5DN9 NAD 0.0000194 0.48207 2.1978
88 4MDB RLT 0.008841 0.43657 2.22222
89 5LD5 NAD 0.00002406 0.44356 2.23464
90 5X20 NAD 0.0002942 0.41674 2.24359
91 2DTX BMA 0.0008892 0.42805 2.27273
92 1X7D ORN 0.0000006723 0.54306 2.28571
93 1X7D NAD 0.0000003171 0.53188 2.28571
94 1YJQ NAP 0.00005862 0.46433 2.31023
95 1ZH8 NAP 0.00002007 0.46309 2.35294
96 1R6D DAU 0.001133 0.43577 2.37389
97 1R6D NAD 0.001199 0.43566 2.37389
98 2C29 NAP 0.002163 0.41752 2.37389
99 4NTC FAD 0.001019 0.428 2.38806
100 1J49 NAD 0.000002667 0.49871 2.4024
101 4EDF UPG 0.0001492 0.46649 2.41287
102 2ZJ1 ARJ 0.0000002917 0.45601 2.41287
103 2ZJ1 NAD 0.0000003058 0.45484 2.41287
104 4DPL NAP 0.0002176 0.44807 2.41287
105 4EIP FAD 0.0005013 0.44501 2.41287
106 4EIP K2C 0.0005013 0.44501 2.41287
107 4OPC PGT 0.003044 0.44471 2.41287
108 4OPC FDA 0.002672 0.44393 2.41287
109 3CGD COA 0.002355 0.43836 2.41287
110 3CGD FAD 0.002355 0.43836 2.41287
111 3CGD NAD 0.002355 0.43836 2.41287
112 3UOY FAD 0.001958 0.43608 2.41287
113 3UOY NAP 0.001958 0.43608 2.41287
114 4D04 NAP 0.002099 0.43211 2.41287
115 4D04 FAD 0.002099 0.43211 2.41287
116 1I2B NAD 0.001614 0.43138 2.41287
117 4BJZ P3A 0.003309 0.42869 2.41287
118 5HSA FAS 0.001078 0.42706 2.41287
119 3S5W FAD 0.0004551 0.42657 2.41287
120 3M6W SAM 0.007436 0.4241 2.41287
121 3CGB FAD 0.0004988 0.40786 2.41287
122 4MO2 FDA 0.002077 0.41187 2.44565
123 2CVQ NDP 0.000008785 0.50518 2.44648
124 5GZ6 7C3 0.0001061 0.42373 2.45399
125 5GZ6 NDP 0.00007566 0.41884 2.45399
126 3F8D FAD 0.01211 0.40554 2.47678
127 1KEW NAD 0.001208 0.43382 2.49307
128 1KEW TYD 0.005448 0.40728 2.49307
129 3FZG SAM 0.02371 0.40003 2.5
130 3CTY FAD 0.000415 0.44615 2.50784
131 2B4Q NAP 0.002289 0.40924 2.53623
132 1SB8 UD2 0.002455 0.42254 2.55682
133 1SB8 NAD 0.002829 0.41672 2.55682
134 5KKA 6V0 0.00000872 0.49321 2.5641
135 1DRV A3D 0.000124 0.41918 2.5641
136 3O9Z NAD 0.00008481 0.40515 2.5641
137 1VM6 NAD 0.00008962 0.43518 2.63158
138 4ZCC NAI 0.0007203 0.44264 2.67857
139 4ZCC FAD 0.0007203 0.44264 2.67857
140 5JY6 NAD 0.0005904 0.44512 2.68097
141 5KMS NAD 0.001005 0.44196 2.68097
142 3ETG NDP 0.0009621 0.43944 2.68097
143 5BUK FAD 0.0006464 0.43872 2.68097
144 3ETG GLU 0.001066 0.43767 2.68097
145 3ETG GTP 0.000693 0.43756 2.68097
146 5JCM NAD 0.001756 0.43664 2.68097
147 4FWE FAD 0.0007567 0.43506 2.68097
148 5UAO FAD 0.0005586 0.43453 2.68097
149 1GET NAP 0.002554 0.43202 2.68097
150 3GD4 NAD 0.003077 0.4318 2.68097
151 1GET FAD 0.002405 0.43177 2.68097
152 3L9W AMP 0.0003528 0.43056 2.68097
153 5JCM ISD 0.00255 0.43007 2.68097
154 5JCM FAD 0.002453 0.43007 2.68097
155 3GD4 FAD 0.002244 0.42802 2.68097
156 4BV6 FAD 0.001603 0.42048 2.68097
157 5KMS FAD 0.001529 0.4157 2.68097
158 1U1J MET 0.02939 0.41264 2.68097
159 1PGP 6PG 0.002067 0.4108 2.68097
160 3L9W GSH 0.001095 0.40829 2.68097
161 1KNR FAD 0.003563 0.40622 2.68097
162 1PJS NAD 0.00005371 0.4058 2.68097
163 4BVA NDP 0.000006051 0.4952 2.68657
164 4BVA T3 0.00002383 0.48623 2.68657
165 3LZW FAD 0.0002153 0.41435 2.71084
166 4USR FAD 0.002867 0.4019 2.77008
167 2HMT NAI 0.00005456 0.4246 2.77778
168 4NBU NAI 0.0006191 0.42793 2.8
169 3G89 SAM 0.005599 0.43389 2.81124
170 5L4S 6KX 0.003072 0.40547 2.83019
171 5L4S NAP 0.003072 0.40547 2.83019
172 4D42 W0I 0.006035 0.40553 2.83688
173 4D42 NAP 0.006035 0.40553 2.83688
174 2AG5 NAD 0.001762 0.40296 2.84553
175 3WGT QSC 0.001338 0.4303 2.88184
176 3WGT FAD 0.00127 0.43027 2.88184
177 2YIP YIO 0.04492 0.40108 2.89855
178 1SC6 NAD 0.00001078 0.48983 2.94906
179 2AQJ FAD 0.001494 0.43584 2.94906
180 2AQJ TRP 0.00143 0.43584 2.94906
181 1GPE FAD 0.001359 0.42724 2.94906
182 4REP FAD 0.0009383 0.42717 2.94906
183 3R75 PYR 0.03413 0.40765 2.94906
184 4JDR FAD 0.0002364 0.40298 2.94906
185 3G5S FAD 0.0007898 0.4001 2.94906
186 4ITU NAI 0.0008473 0.41619 2.97398
187 1GR0 NAD 0.00001601 0.48676 2.99728
188 3BAZ NAP 0.0000004449 0.5712 3.003
189 1DXY NAD 0.00000332 0.48564 3.003
190 2GZ3 NAP 0.00003981 0.48992 3.00546
191 1FS5 TLA 0.007818 0.42306 3.00752
192 4USQ FAD 0.001197 0.41722 3.04709
193 1GEE NAD 0.002582 0.40725 3.06513
194 1EBF NAD 0.000002737 0.48078 3.07263
195 2YGM GLA NAG GAL FUC 0.03963 0.4025 3.10734
196 1FK8 NAD 0.005566 0.40458 3.11284
197 1WP4 NDP 0.000002936 0.52817 3.11419
198 1F06 2NP 0.0001016 0.45697 3.125
199 1F06 NDP 0.0001016 0.45697 3.125
200 2QZZ EMF 0.001919 0.41429 3.14465
201 2QZZ NAP 0.001791 0.41429 3.14465
202 2B4R NAD 0.000009778 0.48742 3.18841
203 2B4R AES 0.0000297 0.46564 3.18841
204 2CFC NAD 0.002138 0.41301 3.2
205 3U4C NDP 0.001418 0.40289 3.20285
206 2EWM NAD 0.000416 0.43438 3.21285
207 1GQ2 NAP 0.000001888 0.53096 3.21716
208 1BZL FAD 0.0006963 0.46824 3.21716
209 1U8X NAD 0.0001629 0.46326 3.21716
210 2QRK AMP 0.000111 0.46102 3.21716
211 2BH9 NAP 0.00138 0.45887 3.21716
212 1YKJ FAD 0.0005793 0.45466 3.21716
213 1YKJ PHB 0.0005793 0.45466 3.21716
214 1X87 NAD 0.00002163 0.4444 3.21716
215 1PS9 NAP 0.00008161 0.43692 3.21716
216 2HQM FAD 0.0007795 0.43351 3.21716
217 1PS9 FAD 0.0009025 0.43001 3.21716
218 4CNK FAD 0.0008164 0.42831 3.21716
219 2VVM FAD 0.001283 0.42312 3.21716
220 1QMG APX 0.002781 0.42289 3.21716
221 4RPL 3UC 0.006568 0.41465 3.21716
222 4RPL FAD 0.007279 0.41094 3.21716
223 4GUT FAD 0.0008709 0.4357 3.22581
224 4HSU FAD 0.0009092 0.43301 3.22581
225 3OFK SAH 0.01695 0.40378 3.24074
226 5THQ NDP 0.00137 0.40658 3.30882
227 1HDG NAD 0.00005954 0.48475 3.31325
228 1NYT NAP 0.000007616 0.52106 3.32103
229 1H5Q NAP 0.001291 0.416 3.39623
230 2AG8 NAP 0.00008128 0.41777 3.42205
231 1E3W NAD 0.0003356 0.44092 3.44828
232 2CVZ NDP 0.00001116 0.46891 3.46021
233 1E6W NAD 0.00118 0.42017 3.46154
234 2ZAT NAP 0.001476 0.40562 3.46154
235 3H9E NAD 0.00001713 0.50234 3.46821
236 1N5D NDP 0.003049 0.40203 3.47222
237 4J4H NAI 0.0000005307 0.56048 3.4749
238 4J4H 1J1 0.0000005307 0.56048 3.4749
239 1OBB NAD 0.00004201 0.4952 3.48525
240 2WPF FAD 0.001107 0.45919 3.48525
241 2WPF WPF 0.001374 0.45671 3.48525
242 1FEC FAD 0.0003334 0.45189 3.48525
243 5BVA FAD 0.0004113 0.4463 3.48525
244 2DKH FAD 0.000269 0.43988 3.48525
245 2DKH 3HB 0.0005096 0.43721 3.48525
246 1Q9I TEO 0.001284 0.43693 3.48525
247 1H82 FAD 0.001491 0.43355 3.48525
248 1H82 GZZ 0.001855 0.43355 3.48525
249 2NVK FAD 0.0008883 0.43028 3.48525
250 3M89 GSP 0.008998 0.42777 3.48525
251 4DSG FAD 0.00332 0.42267 3.48525
252 4DSG UDP 0.00332 0.42267 3.48525
253 1E1M FAD 0.002597 0.42239 3.48525
254 1XHL NDP 0.001233 0.41412 3.48525
255 2IVD FAD 0.0006794 0.4069 3.48525
256 3OID NDP 0.00199 0.40776 3.48837
257 1ZQ9 SAM 0.001437 0.44963 3.50877
258 5ITV NAI 0.000249 0.43642 3.52941
259 4NTD FAD 0.0004984 0.4364 3.52941
260 4XDY NAI 0.0001316 0.43171 3.5503
261 3CMC NAD 0.0001018 0.48753 3.59281
262 1BDB NAD 0.0008346 0.41619 3.61011
263 3CIF NAD 0.000005645 0.48726 3.62117
264 3CIF G3H 0.0001027 0.45823 3.62117
265 3WMX NAD 0.004101 0.40725 3.63128
266 5O4J SAH 0.00005064 0.4682 3.64964
267 5O4J 9KH 0.00005064 0.4682 3.64964
268 5O4J PJL 0.000107 0.45467 3.64964
269 1KYQ NAD 0.000007384 0.4265 3.64964
270 3RC1 TLO 0.001453 0.40406 3.71429
271 5D4V SAH 0.00003086 0.4328 3.73134
272 1F8G NAD 0.0003216 0.46634 3.75335
273 1MO9 KPC 0.0006895 0.4617 3.75335
274 1MO9 FAD 0.0006824 0.46127 3.75335
275 3FWN ATR 0.0001822 0.44756 3.75335
276 3LAD FAD 0.0003613 0.44631 3.75335
277 3SQP FAD 0.007074 0.44321 3.75335
278 3ICS FAD 0.0008396 0.42785 3.75335
279 3ICR FAD 0.001026 0.4234 3.75335
280 2QA1 FAD 0.0003006 0.42273 3.75335
281 5TTJ FAD 0.001431 0.42022 3.75335
282 3ICT FAD 0.001774 0.41445 3.75335
283 5BR7 FAD 0.006775 0.41089 3.75335
284 3AXB FAD 0.0004198 0.40834 3.75335
285 3ICS ADP 0.000006251 0.4083 3.75335
286 5BR7 FLC 0.007863 0.40827 3.75335
287 3ICT ADP 0.000005863 0.40822 3.75335
288 4EUE NAI 0.001832 0.40779 3.75335
289 1TDF NAP 0.005264 0.42041 3.79747
290 1TDF FAD 0.002403 0.41858 3.79747
291 4YAG NAI 0.0007893 0.43331 3.80623
292 4JK3 NAD 0.0000000282 0.55614 3.861
293 1FL2 FAD 0.003199 0.40697 3.87097
294 3TN7 NJP 0.001143 0.4124 3.89105
295 3SJU NDP 0.0006669 0.42672 3.94265
296 4FC7 COA 0.002432 0.41458 3.97112
297 4FC7 NAP 0.002432 0.41458 3.97112
298 1O0S NAI 0.00001654 0.51671 4.02145
299 5G3U FDA 0.0001536 0.45569 4.02145
300 5G3U ITW 0.0006614 0.43834 4.02145
301 2RGJ FAD 0.0003523 0.43555 4.02145
302 1QO8 FAD 0.0009198 0.43076 4.02145
303 3FG2 FAD 0.001083 0.41164 4.02145
304 4MN7 SME 0.0183 0.41617 4.02685
305 1P77 ATR 0.0000006023 0.66392 4.04412
306 4MP8 NAD 0.000004496 0.51204 4.12979
307 4MP8 MLI 0.003447 0.43261 4.12979
308 4D3F NAP 0.0000008572 0.4816 4.19355
309 3WBF NAP 0.000003361 0.52129 4.2623
310 3WBF API 0.000008438 0.48789 4.2623
311 2VHW NAI 0.0000001293 0.56818 4.28954
312 1ZMD NAI 0.00004993 0.48786 4.28954
313 2YVF NAD 0.0004886 0.45687 4.28954
314 2YVF FAD 0.0004788 0.45643 4.28954
315 5U8U FAD 0.0006938 0.45298 4.28954
316 2CDU ADP 0.000001541 0.44265 4.28954
317 3RNM FAD 0.0004882 0.44237 4.28954
318 2Y6Q FAD 0.0003129 0.43603 4.28954
319 2Y6Q I7T 0.0009901 0.43354 4.28954
320 1RYD NDP 0.00009594 0.4316 4.28954
321 4X9M FAD 0.0007911 0.4311 4.28954
322 2CDU FAD 0.0006742 0.42902 4.28954
323 2C7G FAD 0.002459 0.42491 4.28954
324 2C7G ODP 0.002614 0.42307 4.28954
325 3QVP FAD 0.001829 0.42032 4.28954
326 3NKS FAD 0.0004202 0.40949 4.28954
327 5WGR FAD 0.0002165 0.40665 4.28954
328 2DKN NAI 0.001684 0.41702 4.31373
329 4IF4 BEF 0.005539 0.45053 4.32692
330 4JJF FE9 0.001496 0.42183 4.36047
331 4JJF N2I 0.002084 0.41079 4.36047
332 1AE1 NAP 0.0005273 0.42908 4.3956
333 5E8J SAH 0.01653 0.41097 4.48718
334 1Y8Q ATP 0.0001283 0.47513 4.55764
335 2GVC FAD 0.000295 0.4384 4.55764
336 2WET FAD 0.0009101 0.42987 4.55764
337 1VQW FAD 0.000462 0.42467 4.55764
338 2GV8 NDP 0.003087 0.41794 4.55764
339 2GV8 FAD 0.0005343 0.41747 4.55764
340 2RGH FAD 0.001986 0.41589 4.55764
341 1ORR NAD 0.0009203 0.42014 4.61095
342 1XHC FAD 0.0000945 0.46097 4.63215
343 1I8T FAD 0.002766 0.40936 4.63215
344 4ZGS NAD 0.0000009128 0.49384 4.66321
345 2F5Z FAD 0.0003488 0.44799 4.6875
346 2PV7 NAD 0.00001147 0.50493 4.69799
347 1SAY PYR 0.0000008426 0.53422 4.70914
348 3UCL FAD 0.001908 0.43518 4.71204
349 3UCL NAP 0.002138 0.43518 4.71204
350 3UCL CYH 0.001908 0.43518 4.71204
351 1EZ4 NAD 0.0000002163 0.52423 4.71698
352 3H8V ATP 0.00001747 0.42651 4.79452
353 4R5M NAP 0.0003318 0.44427 4.82574
354 4R5M 4NO 0.0003527 0.43706 4.82574
355 2RAB NAD 0.001884 0.43608 4.82574
356 2RAB FAD 0.0008704 0.43374 4.82574
357 1GV0 NAD 0.0000009594 0.51883 4.83871
358 1GUZ NAD 0.0000009153 0.51579 4.83871
359 4RDH AMP 0.00009822 0.51334 4.86111
360 1ZBQ NAD 0.001657 0.40939 4.89297
361 1W73 NAP 0.0003408 0.45757 4.96689
362 1W8D NAP 0.0002694 0.41163 4.96689
363 5DOZ NDP 0.00006604 0.45633 5.02959
364 1CF2 NAP 0.00003617 0.45177 5.04451
365 2YN4 39J 0.02141 0.42304 5.08475
366 1XSE NDP 0.001849 0.41708 5.08475
367 2HK9 NAP 0.000002704 0.49131 5.09091
368 2HK9 ATR 0.0000001979 0.44104 5.09091
369 3NJ4 AFX 0.000005571 0.56688 5.09383
370 3NJ4 NAD 0.000005571 0.56688 5.09383
371 1UWK NAD 0.0001668 0.4625 5.09383
372 1H6C NDP 0.0001354 0.45645 5.09383
373 3T31 DCQ 0.0004984 0.45329 5.09383
374 3T31 FAD 0.0004748 0.45243 5.09383
375 2FR1 NDP 0.0001284 0.45026 5.09383
376 1H6C SIN 0.0003906 0.44159 5.09383
377 1DJN ADP 0.00002367 0.43883 5.09383
378 1REO FAD 0.0005542 0.43583 5.09383
379 4YRY FAD 0.001313 0.42484 5.09383
380 4YRY NAD 0.003342 0.41806 5.09383
381 1V6A TRE 0.00003349 0.57605 5.12048
382 4RL4 PPV 0.01113 0.43158 5.18868
383 3CH6 NAP 0.008719 0.40646 5.24476
384 3CH6 311 0.008719 0.40646 5.24476
385 2YYY NAP 0.00082 0.41243 5.24781
386 2UVO NAG 0.01031 0.43736 5.26316
387 3OA2 NAD 0.00004032 0.47962 5.34591
388 4J36 FAD 0.000064 0.46292 5.36193
389 4J36 1HR 0.0001449 0.46265 5.36193
390 5MQ6 NDP 0.001351 0.43612 5.36193
391 1VKO NAD 0.0004053 0.4319 5.36193
392 2AE2 PTO 0.0005695 0.43653 5.38462
393 2AE2 NAP 0.0005695 0.43653 5.38462
394 5CAE SIN 0.0001467 0.44961 5.43131
395 5CAE COA 0.00003253 0.44305 5.43131
396 5EOW FAD 0.001579 0.41275 5.4321
397 4D79 ATP 0.00004156 0.41372 5.43478
398 4PLT NAI 0.000002497 0.41602 5.43807
399 4PLT OXM 0.000004267 0.41559 5.43807
400 3ABI NAD 0.00000003103 0.59415 5.47945
401 3LU1 NAD 0.003014 0.40469 5.49451
402 3QWI CUE 0.003271 0.40865 5.55556
403 3QWI NAP 0.00198 0.40655 5.55556
404 3SJ7 NDP 0.001166 0.40597 5.55556
405 3OJO NAD 0.00000136 0.48051 5.63003
406 2B9W FAD 0.0008361 0.44353 5.63003
407 4XB2 HSE 0.00005979 0.46246 5.67164
408 4XB2 NDP 0.000009093 0.45942 5.67164
409 5GT9 NAP 0.0004538 0.42701 5.70342
410 1XG5 NAP 0.001191 0.4173 5.73477
411 3A28 NAD 0.001503 0.41618 5.81395
412 5AYV KPL 0.0001229 0.45533 5.82524
413 5AYV NAP 0.0001027 0.42238 5.82524
414 1GEG NAD 0.0008954 0.42473 5.85938
415 1MUU NAD 0.000001907 0.5455 5.89812
416 1MV8 NAD 0.0000006152 0.50832 5.89812
417 1WDK NAD 0.000006113 0.46049 5.89812
418 5E4R NAP 0.0005084 0.41893 5.89812
419 2NU8 COA 0.00002899 0.45355 5.90278
420 4J7U NAP 0.00127 0.42539 5.90278
421 4J7U YTZ 0.00127 0.42539 5.90278
422 1A5Z NAD 0.000004069 0.54782 5.95611
423 4CJX NAP 0.000009713 0.46652 5.95611
424 4E13 NAD 0.000004275 0.45133 6.00707
425 1HKU NAD 0.000002952 0.51469 6.14525
426 2O4C NAD 0.000006971 0.4928 6.16622
427 4TXI FAD 0.0001255 0.45063 6.16622
428 2BRY FAD 0.0003596 0.43523 6.16622
429 1NM5 NAD 0.003094 0.41858 6.16622
430 1L7E NAI 0.0004331 0.40398 6.16622
431 5A04 NDP 0.0002082 0.46751 6.19469
432 5A04 BGC 0.0002656 0.46751 6.19469
433 1WPQ NAD 0.0001648 0.41655 6.30372
434 2OOR NAD 0.000294 0.4006 6.32184
435 9LDB NAD 0.0000003126 0.55113 6.3253
436 9LDT NAD 0.0000003084 0.5412 6.3253
437 4ZVV NAD 0.000001391 0.40937 6.3253
438 4ZVV GN0 0.000001391 0.40937 6.3253
439 2GDZ NAD 0.0008245 0.41484 6.36704
440 1LDM NAD 0.000001227 0.53349 6.38298
441 4HXY NDP 0.00004344 0.46365 6.39269
442 1K3T BRZ 0.0003939 0.43376 6.40669
443 1NVM NAD 0.000005418 0.50484 6.41026
444 4XDZ NDP 0.000365 0.41346 6.41399
445 1V59 FAD 0.0003604 0.44955 6.43432
446 4MIG G3F 0.0005139 0.44654 6.43432
447 1U1I NAD 0.000335 0.43775 6.43432
448 1Z82 NDP 0.0009562 0.42948 6.43432
449 2BGM NAJ 0.0001497 0.42972 6.47482
450 1T26 NAI 0.00000557 0.51571 6.52174
451 2A92 NAI 0.000004747 0.50292 6.54206
452 5FJN FAD 0.001011 0.42919 6.57895
453 5FJN BE2 0.00121 0.42919 6.57895
454 1I0Z NAI 0.000001217 0.53362 6.60661
455 3GDH SAH 0.007305 0.40242 6.639
456 1PZG A3D 0.000001664 0.4898 6.64653
457 2GCG NDP 0.00002029 0.49114 6.66667
458 2PZM UDP 0.005274 0.40262 6.66667
459 2PZM NAD 0.005274 0.40262 6.66667
460 2ZXI FAD 0.0003746 0.41108 6.70241
461 1VBO MAN MAN MAN 0.01775 0.42616 6.71141
462 4ZRN NAD 0.001442 0.40365 6.73077
463 1UXG NAD 0.0000007998 0.54185 6.79612
464 1UXG FUM 0.003818 0.43185 6.79612
465 2F1K NAP 0.000003169 0.53161 6.81004
466 3MJE NDP 0.0006813 0.41745 6.85484
467 4PLG NAI 0.000001425 0.5308 6.88623
468 5JE8 NAD 0.0000007941 0.56097 6.95364
469 1JNR FAD 0.00377 0.42816 6.97051
470 2RGO FAD 0.0019 0.41333 6.97051
471 5TUF FAD 0.001403 0.41205 6.97051
472 5GUD NDP 0.0002275 0.4119 6.97051
473 3MB5 SAM 0.009355 0.40063 7.05882
474 1TE2 PGA 0.0338 0.40952 7.07965
475 2NXE SAM 0.002027 0.44282 7.08661
476 1VL8 NAP 0.0002723 0.43372 7.11611
477 1I36 NAP 0.000405 0.40393 7.19697
478 1J0X NAD 0.00002818 0.48998 7.22892
479 1V8B NAD 0.0000001269 0.56847 7.23861
480 1M2W NAD 0.001135 0.43931 7.23861
481 1K1Y MAL 0.01706 0.4163 7.23861
482 1BW9 NAD 0.0000001438 0.61015 7.30337
483 1BXG NAD 0.0000002323 0.52774 7.30337
484 1C1X NAD 0.0000001024 0.59116 7.32394
485 2YVJ NAI 0.00003266 0.52445 7.33945
486 3D3W NAP 0.0006319 0.42618 7.37705
487 1PR9 NAP 0.0008908 0.42067 7.37705
488 4XZ3 COA 0.00003955 0.43691 7.3913
489 2Q0L NAP 0.0005275 0.4787 7.3955
490 4EMJ FAD 0.001315 0.42161 7.47664
491 2DBZ NAP 0.000000616 0.52203 7.48503
492 1IY8 NAD 0.001455 0.40866 7.49064
493 3ZNN FAD 0.00238 0.42624 7.4928
494 3ZNN 4WL 0.00238 0.42624 7.4928
495 5KVS 6XR 0.00143 0.41307 7.5067
496 5KVS NAP 0.0004528 0.40685 7.5067
497 1CER NAD 0.0000115 0.50925 7.55287
498 3Q3C NAD 0.0003671 0.4095 7.69231
499 2FKA BEF 0.004498 0.46063 7.75194
500 3EGI ADP 0.006805 0.44758 7.76699
501 3OND ADN 0.0000003329 0.56971 7.7748
502 3OND NAD 0.0000003329 0.46571 7.7748
503 5I39 FAD 0.001326 0.42035 7.7748
504 4MDH NAD 0.000006373 0.51495 7.78443
505 2BD0 NAP 0.0008944 0.41925 7.78689
506 5MDH NAD 0.00001003 0.47383 7.80781
507 3FGZ BEF 0.004539 0.46279 7.8125
508 4XYM COA 0.0004575 0.44128 7.82609
509 1UAY ADN 0.008128 0.42601 7.85124
510 5ODQ FAD 0.0002997 0.44942 7.85714
511 4E5N NAD 0.000005207 0.49773 7.87879
512 1JAY NAP 0.0004009 0.40345 8.01887
513 5VN0 NAI 0.0003545 0.44977 8.0429
514 4AP3 FAD 0.001676 0.43459 8.0429
515 4AP3 NAP 0.001676 0.43459 8.0429
516 5JCA FAD 0.00152 0.4224 8.0429
517 5JCA NDP 0.003863 0.42072 8.0429
518 5VN0 FAD 0.0005808 0.40196 8.0429
519 2DT5 NAD 0.0000001024 0.57984 8.05687
520 1TB4 PEJ 0.0003842 0.43869 8.08625
521 2JAP NDP 0.001007 0.42003 8.09717
522 5J60 FAD 0.0009143 0.42871 8.125
523 4K28 NAD 0.0000001933 0.58592 8.17844
524 5N53 8NB 0.01585 0.43084 8.20513
525 3B1F NAD 0.0000004059 0.5908 8.27586
526 3GGO NAI 0.000003148 0.5238 8.28025
527 3GGO ENO 0.000003148 0.5238 8.28025
528 3NGL NAP 0.0000285 0.43801 8.33333
529 4TQG NDP 0.0007622 0.41378 8.35913
530 2EV9 SKM 0.0000103 0.49056 8.36502
531 2EV9 NAP 0.0000103 0.49056 8.36502
532 5UAV TFB 0.000004518 0.5104 8.38509
533 5UAV NDP 0.000004518 0.5104 8.38509
534 1JA9 NDP 0.001578 0.41018 8.39416
535 2V3A FAD 0.0002705 0.44641 8.57909
536 2V3B FAD 0.000272 0.44507 8.57909
537 4PIV NDP 0.0006061 0.42242 8.57909
538 2WSB NAD 0.0009498 0.42808 8.66142
539 4CMI NAP 0.003786 0.40341 8.68056
540 3BMO NAP 0.00428 0.40135 8.68056
541 3BMQ NAP 0.003729 0.40118 8.68056
542 3JQA NAP 0.005099 0.40089 8.68056
543 3JQF NAP 0.003943 0.40025 8.68056
544 1U7T TDT 0.0009628 0.42894 8.81226
545 1U7T NAD 0.00136 0.40021 8.81226
546 1O6Z NAD 0.000004183 0.4734 8.91089
547 4YSX FAD 0.0002321 0.45135 9.04255
548 2CUL FAD 0.0006841 0.40971 9.05172
549 3VYW SAM 0.002795 0.42934 9.09091
550 2X3N FAD 0.0002316 0.41791 9.11528
551 2G5C NAD 0.000009417 0.48346 9.25267
552 3KB6 NAD 0.000001519 0.50312 9.28144
553 2VZ0 NAP 0.01909 0.40006 9.32836
554 2VZ0 D64 0.01909 0.40006 9.32836
555 2IXB NAD 0.00004055 0.47217 9.38338
556 4TM3 FAD 0.002097 0.43552 9.38338
557 2IXB A2G 0.00006038 0.43511 9.38338
558 1LUA NAP 0.00003177 0.43124 9.40767
559 5N2I NAP 0.0001734 0.40788 9.48276
560 1ZEM NAD 0.0001044 0.43456 9.54198
561 2YY7 NAD 0.001172 0.41217 9.61539
562 4RVU NDP 0.00008026 0.46078 9.63855
563 3R4S SIA 0.03664 0.40133 9.65147
564 3LXD FAD 0.0009666 0.42193 9.91957
565 1MFA GLA MMA ABE 0.04385 0.40505 10
566 4K5S FAD 0.0003508 0.42949 10.0746
567 2B5W NAP 0.00000005476 0.55327 10.084
568 4B7X NAP 0.00000756 0.4898 10.119
569 4FN4 NAD 0.0005956 0.43146 10.2362
570 4CQM NAP 0.0003863 0.42614 10.2459
571 1EDO NAP 0.0007741 0.42156 10.2459
572 1LVL NAD 0.0001197 0.48923 10.4558
573 1N9G NAP 0.00009138 0.43556 10.7239
574 2DM6 NAP 0.00001612 0.45347 10.8108
575 2DM6 IMN 0.00001938 0.44725 10.8108
576 3ITJ CIT 0.008127 0.43018 10.9467
577 4WAS NAP 0.0002752 0.4436 10.989
578 4WAS COO 0.0005495 0.43235 10.989
579 2CDC XYP 0.000001196 0.5649 11.2022
580 2CDC NAP 0.000001596 0.55982 11.2022
581 2CDC XYS 0.000001596 0.55982 11.2022
582 2J8Z NAP 0.000009179 0.48277 11.2994
583 1G0N PHH 0.001252 0.42458 11.3074
584 1G0N NDP 0.001148 0.42272 11.3074
585 1DSS NAD 0.00000258 0.4852 11.4114
586 1E6E FAD 0.000813 0.42598 11.7188
587 1D4D FAD 0.000507 0.44175 11.7962
588 2Q1S NAI 0.001294 0.4261 11.7962
589 1C3V NDP 0.00004419 0.47078 11.8367
590 3QJ4 FAD 0.0003972 0.40597 12.2807
591 3AD8 NAD 0.0001542 0.45026 12.3153
592 3AD8 FAD 0.003465 0.42533 12.3153
593 3AD8 PYC 0.003465 0.42533 12.3153
594 1J5P NAD 0.00001597 0.49928 12.6482
595 3GMB FAD 0.001571 0.41282 12.7711
596 4II2 ATP 0.0001996 0.40426 13.253
597 3WV8 ATP 0.00001725 0.43072 13.3028
598 3EGV SAH 0.009283 0.416 13.6054
599 2VT3 ATP 0.0000002612 0.44483 13.9535
600 2GAG NAD 0.0001876 0.45114 14.1414
601 2GAG FAD 0.00158 0.42471 14.1414
602 2GAG FOA 0.001586 0.42465 14.1414
603 1HYH NAD 0.0000007119 0.53778 14.2395
604 1XKQ NDP 0.001805 0.40933 14.2857
605 1DIG NAP 0.00007397 0.45906 14.3791
606 1DIG L37 0.0000814 0.45906 14.3791
607 1WMA AB3 0.00503 0.40341 14.4928
608 1WMA NDP 0.00503 0.40341 14.4928
609 5DP2 NAP 0.0001193 0.43781 14.6199
610 3DXY SAM 0.015 0.4167 14.6789
611 1NVT NAP 0.00001017 0.46355 14.9826
612 5L95 AMP 0.00001106 0.43652 15
613 5JWC FAD 0.0009502 0.42221 15.0134
614 1O94 ADP 0.00002936 0.50164 15.1515
615 1GY8 NAD 0.001429 0.40901 15.2815
616 3NUG NAD 0.001249 0.41098 15.3846
617 2XKO AKG 0.01316 0.43528 15.7303
618 5M67 NAD 0.000000456 0.56572 15.8177
619 5M67 ADE 0.0000005559 0.56236 15.8177
620 5M67 3D1 0.000000557 0.56233 15.8177
621 1LSS NAD 0.000003055 0.45633 16.4286
622 3ICC NAP 0.001819 0.40791 16.8627
623 1LDN NAD 0.0000007978 0.52642 17.7215
624 4EA7 JB2 0.0003849 0.40008 18.6364
625 1VI2 NAD 0.00006057 0.42926 18.6667
626 1NPD NAD 0.0001263 0.47542 19.4444
627 1L5Y BEF 0.01034 0.42563 21.2903
628 3QV1 NAD 0.00001349 0.46049 23.1707
629 4J56 FAD 0.002265 0.41771 23.6842
630 1YB5 NAP 0.000003834 0.5098 25.641
631 4A0S NAP 0.000001388 0.51916 26.8097
632 2VOH CIT 0.03074 0.40846 26.9231
633 3QWB NDP 0.00009476 0.45839 28.1437
634 1KOL NAD 0.0000000002528 0.66957 29.4906
635 5VKT NAP 0.0000000007637 0.63021 29.558
636 3JYN NDP 0.00006271 0.46325 30.1538
637 5FI3 NAP 0.000000005312 0.60067 31.3725
638 1YQD NAP 0.000000002333 0.61569 35.7924
639 3B6Z CO7 0.0003665 0.4335 36.1186
640 5H81 NAP 0.00000006802 0.62411 37.2654
641 4IDC 1XX 0.00004348 0.46913 39.759
642 4IDC NDP 0.00004348 0.46913 39.759
643 3B1J NAD 0.0001117 0.45907 40
644 3TWO NDP 0.0000000002156 0.63452 40.2299
645 1PL6 572 0.000000003502 0.6181 41.573
646 1PL6 NAD 0.0000000001139 0.59777 41.573
647 1KEV NDP 0.00000005576 0.55878 41.8803
648 1YKF NAP 0.00000006857 0.58107 42.3295
649 3GFB NAD 0.000000008431 0.628 43.4286
650 2DFV NAD 0.000000004757 0.59066 44.6686
Pocket No.: 3; Query (leader) PDB : 1D1T; Ligand: NAD; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 3) in the query (biounit: 1d1t.bio1) has 32 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 4; Query (leader) PDB : 1D1T; Ligand: NAD; 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: 1d1t.bio1) has 32 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 5; Query (leader) PDB : 1D1T; Ligand: NAD; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 5) in the query (biounit: 1d1t.bio3) has 33 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 6; Query (leader) PDB : 1D1T; Ligand: NAD; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 6) in the query (biounit: 1d1t.bio3) has 32 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 7; Query (leader) PDB : 1D1T; Ligand: NAD; Similar sites found: 55
This union binding pocket(no: 7) in the query (biounit: 1d1t.bio2) has 32 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 3NTA FAD 0.002129 0.41763 1.60858
2 1YS4 NAP 0.0005404 0.40553 1.69492
3 3I6I NDP 0.005399 0.40186 1.7341
4 1N4W FAD 0.007283 0.40161 1.87668
5 3WQQ NDP 0.0004967 0.44572 2.14477
6 3E1T FAD 0.0008736 0.43817 2.14477
7 2R4J FAD 0.001788 0.43311 2.14477
8 5TUK FAD 0.002185 0.40731 2.41287
9 4MO2 FAD 0.002449 0.41526 2.44565
10 3AYI HCI 0.0007598 0.44907 2.68097
11 3AYI FAD 0.0007233 0.44907 2.68097
12 4C3Y FAD 0.005883 0.40341 2.68097
13 4HA6 FAD 0.004846 0.40864 2.94906
14 4YNU FAD 0.008078 0.40071 2.94906
15 4ITU 1HS 0.001222 0.43137 2.97398
16 5EPO NAP 0.00297 0.4023 3.05344
17 3LRE ADP 0.03543 0.40163 3.38028
18 1Q9I FAD 0.001197 0.44348 3.48525
19 1E1M NAP 0.002221 0.43009 3.48525
20 3OJF IMJ 0.006874 0.40074 3.50195
21 1NFQ NAI 0.003543 0.40202 3.84615
22 3DGY 2GP 0.03646 0.40694 4.12371
23 1ZMD FAD 0.0002576 0.4592 4.28954
24 4IV9 FAD 0.002281 0.41861 4.55764
25 2WZM NA7 0.01437 0.40159 4.59364
26 3AB1 FAD 0.0006983 0.43879 4.72222
27 4I4S LAT 0.03051 0.40552 4.79452
28 4RDI ATP 0.0001083 0.41031 4.86111
29 1UWK URO 0.000102 0.47741 5.09383
30 4Z24 FAD 0.007363 0.4005 5.09383
31 2IID PHE 0.001048 0.44422 5.36193
32 2IID FAD 0.001048 0.44422 5.36193
33 1XCL SAH 0.002088 0.41075 5.53191
34 2Q7V FAD 0.000477 0.44641 5.53846
35 4EMI NAD 0.001089 0.4475 5.63003
36 4EMI FAD 0.001667 0.42177 5.63003
37 3HAD NAD 0.0001106 0.47919 6.16883
38 1T26 GBD 0.04244 0.41942 6.52174
39 4M52 FAD 0.0002233 0.46054 6.70241
40 4PLG OXM 0.003731 0.43593 6.88623
41 2JB2 PHE 0.001072 0.43148 6.97051
42 2JB2 FAD 0.001005 0.43148 6.97051
43 2Z3Y F2N 0.0008649 0.43835 7.23861
44 2YVJ FAD 0.001077 0.428 7.33945
45 2V3V MGD 0.02063 0.40039 7.7748
46 3QFA FAD 0.002518 0.41895 8.62069
47 3ITJ FAD 0.009059 0.40288 10.9467
48 3Q9N COA 0.001177 0.40694 12.766
49 4XUC 43G 0.003244 0.40595 12.844
50 4XUC SAM 0.003244 0.40595 12.844
51 3HVJ 705 0.00557 0.40028 13.1222
52 4J1Q NDP 0.002302 0.40058 14.7453
53 5KQA GSH 0.02624 0.414 15.1515
54 1YQZ FAD 0.003146 0.42772 15.8177
55 5KK4 44E 0.03377 0.40842 16.6667
Pocket No.: 8; Query (leader) PDB : 1D1T; Ligand: NAD; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 8) in the query (biounit: 1d1t.bio2) has 32 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
Pocket No.: 9; Query (leader) PDB : 1D1T; Ligand: NAD; Similar sites found: 4
This union binding pocket(no: 9) in the query (biounit: 1d1t.bio4) has 32 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 1M1B SPV 0.04572 0.40261 1.35593
2 3LL5 IP8 0.02943 0.41323 4.81928
3 2P69 PLP 0.04499 0.40365 6.86275
4 2OHV NHL 0.03243 0.406 7.19697
Pocket No.: 10; Query (leader) PDB : 1D1T; Ligand: NAD; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 10) in the query (biounit: 1d1t.bio4) has 32 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
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