Receptor
PDB id Resolution Class Description Source Keywords
1sg0 1.5 Å EC: 1.10.5.1 CRYSTAL STRUCTURE ANALYSIS OF QR2 IN COMPLEX WITH RESVERATROL HOMO SAPIENS QUINONE REDUCTASE 2 RESVERATROL OXIDOREDUCTASE
Ref.: CRYSTAL STRUCTURE OF QUINONE REDUCTASE 2 IN COMPLEX WITH RESVERATROL BIOCHEMISTRY V. 43 11417 2004
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
FAD A:434;
B:433;
 Valid;
Valid;
 none;
none;
 submit data
785.55 C27 H33 N9 O15 P2 Cc1cc...
STL A:501;
B:502;
 Valid;
Valid;
 none;
none;
 Kd = 35 nM
228.243 C14 H12 O3 c1cc(...
ZN A:231;
B:232;
 Part of Protein;
Part of Protein;
 none;
none;
 submit data
65.409 Zn [Zn+2...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
3UXH 1.53 Å EC: 1.10.5.1 DESIGN, SYNTHESIS AND BIOLOGICAL EVALUATION OF POTETENT QUIN PYRROLOQUINOLINE AMMOSAMIDE ANALOGUES AS INHIBITORS OF QUINR EDUCTASE 2 HOMO SAPIENS QUINONE REDUCTASE CYTOSOL OXIDOREDUCTASE-INHIBITOR COMPLEX
Ref.: DESIGN, SYNTHESIS, AND BIOLOGICAL EVALUATION OF POT QUINOLINE AND PYRROLOQUINOLINE AMMOSAMIDE ANALOGUES INHIBITORS OF QUINONE REDUCTASE 2. J.MED.CHEM. V. 55 367 2012
Members (37)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 5LBY - 6T2 C26 H29 N5 O2 CC1(COC1)C....
2 2QX9 Kd = 0.7 uM ML2 C13 H15 I N2 O2 CC(=O)NCCc....
3 3OWX ic50 = 17600 nM XRA C19 H21 N5 O4 COc1cc2c(c....
4 3TE7 ic50 = 59 nM TE7 C19 H20 N4 O2 CN(C)CCNc1....
5 4U7F - K25 C9 H7 Br4 N3 CN(C)c1[nH....
6 3TEM ic50 = 14 nM 6A1 C19 H25 N4 O3 C[N+](C)(C....
7 1SG0 Kd = 35 nM STL C14 H12 O3 c1cc(ccc1C....
8 1XI2 ic50 < 1 uM CB1 C9 H8 N4 O5 c1c(c(cc(c....
9 3O73 Kd = 19 uM O73 C21 H24 N4 O5 Cc1c(c2c(n....
10 3UXH ic50 = 0.061 nM UXH C12 H10 Cl N5 O2 CN1c2c3c(c....
11 4ZVM Kd = 274 nM DM2 C27 H29 N O11 C[C@H]1[C@....
12 3GAM ic50 = 4.1 uM MXX C13 H15 N O3 CC1=CC(=O)....
13 1QR2 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
14 5LBW - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
15 3G5M ic50 = 54.1 uM XM5 C12 H11 N O4 CN1c2c(ccc....
16 3UXE ic50 = 0.0041 uM 465 C13 H10 Cl N5 O2 CN1c2c3c(c....
17 4ZVN Kd = 0.36 nM AO C17 H20 N3 CN(C)c1ccc....
18 4GQI ic50 = 20.7 uM M49 C14 H17 N3 O3 CC(=O)NCC[....
19 2QWX Kd = 1.4 uM ML1 C13 H16 N2 O2 CC(=O)NCCc....
20 2QX4 Kd = 1.4 uM ML1 C13 H16 N2 O2 CC(=O)NCCc....
21 4U7H Kd = 36.4 nM K25 C9 H7 Br4 N3 CN(C)c1[nH....
22 2QR2 - VK3 C11 H8 O2 CC1=CC(=O)....
23 2BZS - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
24 3OX1 ic50 = 7100 nM 695 C15 H18 N2 O3 S CC(=O)NCCc....
25 2QX8 Kd = 0.7 uM ML2 C13 H15 I N2 O2 CC(=O)NCCc....
26 3FW1 ic50 = 80 nM STI C29 H31 N7 O Cc1ccc(cc1....
27 4ZVK - ET C21 H20 N3 CC[n+]1c2c....
28 3OWH ic50 = 1900 nM 52X C14 H16 I N3 O3 CC(=O)NCCc....
29 4ZVL Kd = 29.4 nM AO C17 H20 N3 CN(C)c1ccc....
30 5LBZ - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
31 3OX3 ic50 = 11 nM 4X4 C21 H18 N4 O3 COc1ccc2c(....
32 2QX6 Kd = 1.4 uM ML1 C13 H16 N2 O2 CC(=O)NCCc....
33 4U7G Kd = 18.1 nM K17 C7 H2 Br4 N2 c1[nH]c2c(....
34 1ZX1 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
35 4GR9 ic50 = 7 uM 372 C13 H13 N3 O2 CC(=O)Nc1c....
36 3OX2 ic50 = 704 nM 79X C17 H13 N O4 COc1cc-2c(....
37 3OVM ic50 = 37100 nM MZC C14 H17 N3 O3 CC(=O)NCCc....
70% Homology Family (37)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 5LBY - 6T2 C26 H29 N5 O2 CC1(COC1)C....
2 2QX9 Kd = 0.7 uM ML2 C13 H15 I N2 O2 CC(=O)NCCc....
3 3OWX ic50 = 17600 nM XRA C19 H21 N5 O4 COc1cc2c(c....
4 3TE7 ic50 = 59 nM TE7 C19 H20 N4 O2 CN(C)CCNc1....
5 4U7F - K25 C9 H7 Br4 N3 CN(C)c1[nH....
6 3TEM ic50 = 14 nM 6A1 C19 H25 N4 O3 C[N+](C)(C....
7 1SG0 Kd = 35 nM STL C14 H12 O3 c1cc(ccc1C....
8 1XI2 ic50 < 1 uM CB1 C9 H8 N4 O5 c1c(c(cc(c....
9 3O73 Kd = 19 uM O73 C21 H24 N4 O5 Cc1c(c2c(n....
10 3UXH ic50 = 0.061 nM UXH C12 H10 Cl N5 O2 CN1c2c3c(c....
11 4ZVM Kd = 274 nM DM2 C27 H29 N O11 C[C@H]1[C@....
12 3GAM ic50 = 4.1 uM MXX C13 H15 N O3 CC1=CC(=O)....
13 1QR2 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
14 5LBW - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
15 3G5M ic50 = 54.1 uM XM5 C12 H11 N O4 CN1c2c(ccc....
16 3UXE ic50 = 0.0041 uM 465 C13 H10 Cl N5 O2 CN1c2c3c(c....
17 4ZVN Kd = 0.36 nM AO C17 H20 N3 CN(C)c1ccc....
18 4GQI ic50 = 20.7 uM M49 C14 H17 N3 O3 CC(=O)NCC[....
19 2QWX Kd = 1.4 uM ML1 C13 H16 N2 O2 CC(=O)NCCc....
20 2QX4 Kd = 1.4 uM ML1 C13 H16 N2 O2 CC(=O)NCCc....
21 4U7H Kd = 36.4 nM K25 C9 H7 Br4 N3 CN(C)c1[nH....
22 2QR2 - VK3 C11 H8 O2 CC1=CC(=O)....
23 2BZS - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
24 3OX1 ic50 = 7100 nM 695 C15 H18 N2 O3 S CC(=O)NCCc....
25 2QX8 Kd = 0.7 uM ML2 C13 H15 I N2 O2 CC(=O)NCCc....
26 3FW1 ic50 = 80 nM STI C29 H31 N7 O Cc1ccc(cc1....
27 4ZVK - ET C21 H20 N3 CC[n+]1c2c....
28 3OWH ic50 = 1900 nM 52X C14 H16 I N3 O3 CC(=O)NCCc....
29 4ZVL Kd = 29.4 nM AO C17 H20 N3 CN(C)c1ccc....
30 5LBZ - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
31 3OX3 ic50 = 11 nM 4X4 C21 H18 N4 O3 COc1ccc2c(....
32 2QX6 Kd = 1.4 uM ML1 C13 H16 N2 O2 CC(=O)NCCc....
33 4U7G Kd = 18.1 nM K17 C7 H2 Br4 N2 c1[nH]c2c(....
34 1ZX1 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
35 4GR9 ic50 = 7 uM 372 C13 H13 N3 O2 CC(=O)Nc1c....
36 3OX2 ic50 = 704 nM 79X C17 H13 N O4 COc1cc-2c(....
37 3OVM ic50 = 37100 nM MZC C14 H17 N3 O3 CC(=O)NCCc....
50% Homology Family (51)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 5LBY - 6T2 C26 H29 N5 O2 CC1(COC1)C....
2 2QX9 Kd = 0.7 uM ML2 C13 H15 I N2 O2 CC(=O)NCCc....
3 3OWX ic50 = 17600 nM XRA C19 H21 N5 O4 COc1cc2c(c....
4 3TE7 ic50 = 59 nM TE7 C19 H20 N4 O2 CN(C)CCNc1....
5 4U7F - K25 C9 H7 Br4 N3 CN(C)c1[nH....
6 3TEM ic50 = 14 nM 6A1 C19 H25 N4 O3 C[N+](C)(C....
7 1SG0 Kd = 35 nM STL C14 H12 O3 c1cc(ccc1C....
8 1XI2 ic50 < 1 uM CB1 C9 H8 N4 O5 c1c(c(cc(c....
9 3O73 Kd = 19 uM O73 C21 H24 N4 O5 Cc1c(c2c(n....
10 3UXH ic50 = 0.061 nM UXH C12 H10 Cl N5 O2 CN1c2c3c(c....
11 4ZVM Kd = 274 nM DM2 C27 H29 N O11 C[C@H]1[C@....
12 3GAM ic50 = 4.1 uM MXX C13 H15 N O3 CC1=CC(=O)....
13 1QR2 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
14 5LBW - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
15 3G5M ic50 = 54.1 uM XM5 C12 H11 N O4 CN1c2c(ccc....
16 3UXE ic50 = 0.0041 uM 465 C13 H10 Cl N5 O2 CN1c2c3c(c....
17 4ZVN Kd = 0.36 nM AO C17 H20 N3 CN(C)c1ccc....
18 4GQI ic50 = 20.7 uM M49 C14 H17 N3 O3 CC(=O)NCC[....
19 2QWX Kd = 1.4 uM ML1 C13 H16 N2 O2 CC(=O)NCCc....
20 2QX4 Kd = 1.4 uM ML1 C13 H16 N2 O2 CC(=O)NCCc....
21 4U7H Kd = 36.4 nM K25 C9 H7 Br4 N3 CN(C)c1[nH....
22 2QR2 - VK3 C11 H8 O2 CC1=CC(=O)....
23 2BZS - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
24 3OX1 ic50 = 7100 nM 695 C15 H18 N2 O3 S CC(=O)NCCc....
25 2QX8 Kd = 0.7 uM ML2 C13 H15 I N2 O2 CC(=O)NCCc....
26 3FW1 ic50 = 80 nM STI C29 H31 N7 O Cc1ccc(cc1....
27 4ZVK - ET C21 H20 N3 CC[n+]1c2c....
28 3OWH ic50 = 1900 nM 52X C14 H16 I N3 O3 CC(=O)NCCc....
29 4ZVL Kd = 29.4 nM AO C17 H20 N3 CN(C)c1ccc....
30 5LBZ - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
31 3OX3 ic50 = 11 nM 4X4 C21 H18 N4 O3 COc1ccc2c(....
32 2QX6 Kd = 1.4 uM ML1 C13 H16 N2 O2 CC(=O)NCCc....
33 4U7G Kd = 18.1 nM K17 C7 H2 Br4 N2 c1[nH]c2c(....
34 1ZX1 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
35 4GR9 ic50 = 7 uM 372 C13 H13 N3 O2 CC(=O)Nc1c....
36 3OX2 ic50 = 704 nM 79X C17 H13 N O4 COc1cc-2c(....
37 3OVM ic50 = 37100 nM MZC C14 H17 N3 O3 CC(=O)NCCc....
38 1QBG - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
39 1KBO - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
40 3JSX ic50 = 7.7 nM CC2 C22 H18 O3 Cc1cc2c(cc....
41 1KBQ Ki = 0.45 uM 936 C18 H16 N2 O6 Cc1c(c2c(n....
42 1H66 - RH1 C12 H14 N2 O3 CC1=C(C(=O....
43 4CET Kd = 428 nM FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
44 6LLC - EHL C14 H10 N4 O4 S Cc1c(c(no1....
45 1H69 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
46 1D4A - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
47 1GG5 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
48 5EA2 - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
49 5A4K Kd = 155 nM FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
50 1DXO - FAD C27 H33 N9 O15 P2 Cc1cc2c(cc....
51 1QRD - DQN C10 H12 O2 CC1=C(C(=O....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: FAD; Similar ligands found: 147
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 UBG 0.845588 0.987654
6 6FA 0.794118 0.987654
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 JNT 0.598425 0.876543
12 FAJ 0.57485 0.97561
13 62F 0.572327 0.939024
14 F2N 0.566265 0.886364
15 FMN 0.543307 0.876543
16 FA9 0.526316 0.939759
17 6YU 0.516304 0.860215
18 CNV FAD 0.511905 0.908046
19 P6G FDA 0.511628 0.908046
20 FAD NBT 0.508876 0.83871
21 A2D 0.504065 0.875
22 DAL FAD PER 0.491429 0.836957
23 P5F 0.491329 0.941176
24 FAD CNX 0.488506 0.8125
25 APR 0.488372 0.851852
26 AR6 0.488372 0.851852
27 FAD T2C 0.485876 0.819149
28 AGS 0.484615 0.811765
29 M33 0.484375 0.864198
30 BA3 0.484127 0.875
31 ATP 0.48062 0.851852
32 HEJ 0.48062 0.851852
33 B4P 0.480315 0.875
34 ADP 0.480315 0.851852
35 AP5 0.480315 0.875
36 ANP 0.477273 0.831325
37 5FA 0.476923 0.851852
38 AQP 0.476923 0.851852
39 48N 0.469388 0.902439
40 OAD 0.467626 0.876543
41 9X8 0.467626 0.833333
42 FAD NBA 0.467033 0.793814
43 GTA 0.465753 0.892857
44 AT4 0.465116 0.821429
45 AN2 0.465116 0.841463
46 HQG 0.463235 0.841463
47 AD9 0.462121 0.831325
48 3OD 0.460993 0.876543
49 RBF 0.460938 0.790123
50 FB0 0.460606 0.835165
51 139 0.460526 0.858824
52 AP0 0.46 0.835294
53 A22 0.459854 0.864198
54 ACP 0.458015 0.853659
55 8QN 0.456522 0.864198
56 PRX 0.454545 0.831325
57 A3R 0.453237 0.86747
58 A1R 0.453237 0.86747
59 G3A 0.452055 0.902439
60 T5A 0.45098 0.872093
61 G5P 0.44898 0.902439
62 ATF 0.448529 0.821429
63 50T 0.44697 0.819277
64 OZV 0.446043 0.851852
65 6YZ 0.445255 0.853659
66 ACQ 0.444444 0.853659
67 ADQ 0.442857 0.853659
68 PAJ 0.442857 0.847059
69 KMQ 0.441379 0.843373
70 8LE 0.441176 0.855422
71 5AL 0.441176 0.864198
72 ADX 0.439394 0.775281
73 CA0 0.439394 0.853659
74 8LQ 0.438849 0.865854
75 QA7 0.438849 0.855422
76 A4P 0.437909 0.831461
77 25L 0.4375 0.864198
78 P33 FDA 0.436464 0.817204
79 KG4 0.43609 0.853659
80 5SV 0.435714 0.793103
81 8LH 0.434783 0.843373
82 OMR 0.434211 0.818182
83 TXE 0.434211 0.890244
84 45A 0.434109 0.829268
85 ABM 0.434109 0.829268
86 AMP 0.433071 0.82716
87 A 0.433071 0.82716
88 4AD 0.432624 0.855422
89 ADJ 0.432258 0.818182
90 B5M 0.431507 0.878049
91 B5Y 0.431507 0.878049
92 BIS 0.430556 0.802326
93 DJC FAD 0.43 0.827957
94 SRA 0.429688 0.788235
95 AFH 0.42953 0.825581
96 DND 0.427632 0.865854
97 TXD 0.427632 0.890244
98 UP5 0.427632 0.878049
99 6V0 0.427632 0.857143
100 DQV 0.426667 0.8875
101 SRP 0.42446 0.843373
102 PR8 0.423611 0.837209
103 TAT 0.423358 0.821429
104 T99 0.423358 0.821429
105 AMO 0.422535 0.865854
106 PTJ 0.42069 0.835294
107 TXA 0.42069 0.865854
108 FYA 0.42069 0.864198
109 CNA 0.420382 0.865854
110 AHX 0.41958 0.835294
111 00A 0.41958 0.823529
112 AMP MG 0.418605 0.814815
113 MAP 0.41844 0.811765
114 NAI 0.418301 0.845238
115 AU1 0.41791 0.831325
116 A12 0.416667 0.843373
117 AP2 0.416667 0.843373
118 9ZD 0.415493 0.845238
119 25A 0.415493 0.851852
120 9ZA 0.415493 0.845238
121 COD 0.415094 0.842697
122 4TC 0.412903 0.879518
123 APC 0.411765 0.843373
124 ME8 0.410959 0.806818
125 1ZZ 0.410959 0.806818
126 NB8 0.410959 0.835294
127 ADP BEF 0.410448 0.82716
128 ADP MG 0.410448 0.82716
129 DJ0 FAD 0.41 0.865169
130 4UW 0.409091 0.825581
131 NAX 0.409091 0.837209
132 F2R 0.408805 0.850575
133 ADV 0.408759 0.843373
134 RBY 0.408759 0.843373
135 VO4 ADP 0.407143 0.809524
136 P1H 0.405882 0.818182
137 BEF ADP 0.405797 0.807229
138 OOB 0.405594 0.864198
139 LAD 0.40411 0.825581
140 UPA 0.403846 0.86747
141 4UU 0.401316 0.833333
142 GA7 0.401316 0.865854
143 A3D 0.401235 0.876543
144 80F 0.401235 0.808989
145 DLL 0.4 0.864198
146 XAH 0.4 0.806818
147 V2G 0.4 0.857143
Ligand no: 2; Ligand: STL; Similar ligands found: 6
No: Ligand ECFP6 Tc MDL keys Tc
1 STL 1 1
2 BVB 0.648649 0.782609
3 3RL 0.52381 0.708333
4 PIT 0.512195 0.791667
5 R4G 0.433333 0.633333
6 R3X 0.412698 0.633333
Similar Ligands (3D)
Ligand no: 1; Ligand: FAD; Similar ligands found: 1
No: Ligand Similarity coefficient
1 FDA T2C 0.8610
Ligand no: 2; Ligand: STL; Similar ligands found: 372
No: Ligand Similarity coefficient
1 RE2 0.9849
2 IEE 0.9813
3 IW3 0.9772
4 IW5 0.9727
5 83D 0.9710
6 V15 0.9665
7 RE4 0.9553
8 LJ1 0.9491
9 245 0.9449
10 OA5 0.9413
11 LJ2 0.9410
12 D8Y 0.9381
13 CWP 0.9374
14 8KW 0.9335
15 MR4 0.9331
16 IW4 0.9311
17 0OP 0.9311
18 LJ5 0.9302
19 ZTW 0.9296
20 6IP 0.9293
21 TPM 0.9292
22 G2V 0.9276
23 1UA 0.9271
24 K0G 0.9264
25 BSU 0.9250
26 N0H 0.9239
27 397 0.9220
28 EMU 0.9214
29 FHV 0.9204
30 WA1 0.9202
31 8M5 0.9200
32 MR5 0.9199
33 OSY 0.9195
34 0XR 0.9188
35 MR6 0.9180
36 HCC 0.9179
37 3MI 0.9169
38 4P9 0.9165
39 U13 0.9165
40 1A6 0.9164
41 9EG 0.9162
42 OLU 0.9151
43 2M7 0.9150
44 907 0.9148
45 4RG 0.9137
46 NAR 0.9134
47 6H2 0.9129
48 NXY 0.9120
49 D8B 0.9116
50 CMG 0.9115
51 AEY 0.9113
52 5TU 0.9113
53 F18 0.9106
54 PW5 0.9090
55 NW1 0.9079
56 L2K 0.9077
57 8E3 0.9077
58 LZ7 0.9075
59 ESJ 0.9071
60 MRE 0.9068
61 AJ6 0.9067
62 WA2 0.9066
63 0NJ 0.9065
64 YIP 0.9063
65 EDZ 0.9059
66 FBC 0.9057
67 AOY 0.9056
68 8EC 0.9055
69 041 0.9053
70 135 0.9052
71 7ZO 0.9044
72 L12 0.9043
73 1UR 0.9037
74 NX1 0.9036
75 A26 0.9033
76 RNK 0.9032
77 23M 0.9030
78 NU3 0.9028
79 AHR AHR 0.9028
80 94X 0.9024
81 ZRK 0.9018
82 S0B 0.9018
83 7FZ 0.9016
84 FY8 0.9014
85 47V 0.9013
86 DZ3 0.9012
87 T03 0.9009
88 1UZ 0.9009
89 F91 0.9008
90 IIH 0.9007
91 MHB 0.9005
92 SJR 0.9004
93 S0A 0.9002
94 1UT 0.9002
95 3TI 0.9001
96 CIU 0.9000
97 J2N 0.8995
98 UN4 0.8992
99 8E6 0.8990
100 1V0 0.8990
101 6BK 0.8990
102 BMC 0.8988
103 08C 0.8986
104 97K 0.8980
105 NZ4 0.8979
106 A51 0.8978
107 334 0.8978
108 C4E 0.8978
109 5S9 0.8975
110 J3B 0.8975
111 1V8 0.8974
112 M16 0.8971
113 5OR 0.8968
114 KVD 0.8967
115 136 0.8964
116 9JT 0.8962
117 IW1 0.8961
118 IW2 0.8961
119 WG8 0.8959
120 1Q2 0.8959
121 EES 0.8956
122 7G2 0.8954
123 1W4 0.8953
124 4TX 0.8952
125 S16 0.8952
126 A63 0.8947
127 AGI 0.8945
128 H32 0.8939
129 27F 0.8938
130 124 0.8937
131 BGC BGC 0.8936
132 68B 0.8932
133 2OX 0.8931
134 O9T 0.8931
135 A45 0.8930
136 LU2 0.8929
137 KLS 0.8928
138 D59 0.8927
139 1R5 0.8925
140 UAY 0.8925
141 2L1 0.8923
142 ZRL 0.8923
143 HPK 0.8923
144 802 0.8922
145 TH1 0.8921
146 697 0.8921
147 0ON 0.8919
148 LND 0.8918
149 68C 0.8916
150 F08 0.8914
151 HPZ 0.8914
152 WCU 0.8909
153 AZB 0.8905
154 0SY 0.8904
155 25K 0.8904
156 GN5 0.8901
157 BUN 0.8899
158 ZEA 0.8899
159 7EH 0.8895
160 O9Z 0.8893
161 120 0.8892
162 0QR 0.8891
163 C0E 0.8888
164 20D 0.8888
165 7G0 0.8886
166 A64 0.8883
167 801 0.8883
168 4YE 0.8882
169 C4F 0.8882
170 06R 0.8880
171 29F 0.8880
172 CR4 0.8880
173 DFL 0.8879
174 DTB 0.8874
175 EEY 0.8872
176 6X1 0.8870
177 H35 0.8869
178 U14 0.8868
179 NX5 0.8868
180 N5B 0.8868
181 WF4 0.8867
182 MJW 0.8866
183 GW9 0.8866
184 DZ1 0.8863
185 3IP 0.8862
186 CDX 0.8862
187 5VU 0.8860
188 DMB 0.8858
189 3JC 0.8857
190 SE5 0.8857
191 SZ5 0.8856
192 122 0.8856
193 BMZ 0.8855
194 SFY 0.8854
195 T07 0.8850
196 CWE 0.8849
197 ZYC 0.8843
198 WW3 0.8842
199 LMZ 0.8842
200 4KN 0.8842
201 6JP 0.8841
202 HPX 0.8841
203 AJ4 0.8841
204 GJB 0.8840
205 0V7 0.8840
206 JZ8 0.8840
207 F36 0.8840
208 5LP 0.8839
209 A0R 0.8838
210 C1E 0.8837
211 121 0.8835
212 J2W 0.8832
213 1V1 0.8831
214 2P3 0.8831
215 S0D 0.8828
216 IJ1 0.8828
217 1SX 0.8827
218 5ER 0.8827
219 3K1 0.8827
220 HDI 0.8825
221 CBE 0.8823
222 O53 0.8819
223 D26 0.8817
224 LR2 0.8813
225 3F4 0.8812
226 A73 0.8812
227 1Q1 0.8809
228 DZ2 0.8809
229 1XS 0.8806
230 4CN 0.8805
231 9M9 0.8804
232 Y27 0.8803
233 NNF 0.8799
234 QME 0.8799
235 833 0.8797
236 XAV 0.8795
237 39R 0.8794
238 PNW 0.8794
239 W2E 0.8790
240 3Q0 0.8789
241 25F 0.8789
242 P4T 0.8788
243 7LU 0.8784
244 6T5 0.8784
245 XYP XYP 0.8783
246 J8D 0.8778
247 0X2 0.8776
248 5RV 0.8773
249 Q92 0.8772
250 YKN 0.8772
251 JBB 0.8771
252 TVC 0.8768
253 LI7 0.8765
254 OUA 0.8764
255 4FC 0.8763
256 IDZ 0.8762
257 38E 0.8760
258 3N0 0.8758
259 338 0.8756
260 ZIP 0.8755
261 RGK 0.8752
262 BGC GAL 0.8750
263 IPJ 0.8749
264 TID 0.8748
265 1HP 0.8742
266 Z3R 0.8742
267 X2L 0.8742
268 244 0.8741
269 AT2 0.8740
270 HWB 0.8740
271 QDR 0.8739
272 NKI 0.8737
273 AUY 0.8735
274 613 0.8734
275 91F 0.8732
276 31F 0.8731
277 RDV 0.8730
278 47X 0.8729
279 A6E 0.8727
280 LWA 0.8725
281 S7D 0.8725
282 NQE 0.8724
283 PJK 0.8723
284 L43 0.8722
285 5EZ 0.8722
286 BU7 0.8720
287 4B8 0.8719
288 GAL BGC 0.8713
289 2WU 0.8712
290 IMI 0.8712
291 6EO 0.8710
292 0QA 0.8707
293 R3S 0.8707
294 N08 0.8704
295 OUG 0.8701
296 BTN 0.8699
297 BMU 0.8699
298 JL7 0.8699
299 72G 0.8696
300 6B5 0.8695
301 DX8 0.8691
302 3D8 0.8690
303 6P3 0.8690
304 MI2 0.8689
305 RF2 0.8688
306 147 0.8687
307 BX4 0.8686
308 DFV 0.8686
309 XYS XYS 0.8685
310 1WZ 0.8675
311 2QV 0.8675
312 TVZ 0.8672
313 A9B 0.8670
314 246 0.8669
315 SAK 0.8668
316 797 0.8667
317 HAR 0.8665
318 AV6 0.8664
319 5E5 0.8663
320 AJ8 0.8662
321 NQK 0.8660
322 Q11 0.8658
323 5WW 0.8656
324 D4G 0.8654
325 NE2 0.8650
326 D64 0.8649
327 ESE 0.8647
328 S45 0.8643
329 T21 0.8641
330 NPZ 0.8641
331 NNL 0.8639
332 E9L 0.8636
333 AP6 0.8635
334 6QT 0.8633
335 IJ6 0.8633
336 OSJ 0.8632
337 KMP 0.8629
338 0UL 0.8628
339 57D 0.8624
340 GB5 0.8623
341 4ZF 0.8620
342 72H 0.8618
343 FYR 0.8612
344 HHV 0.8611
345 3D3 0.8607
346 789 0.8606
347 2L2 0.8603
348 79X 0.8603
349 GEN 0.8601
350 PIQ 0.8597
351 5XM 0.8592
352 AVX 0.8589
353 PCQ 0.8586
354 5TO 0.8580
355 JTE 0.8576
356 QS4 0.8575
357 U55 0.8572
358 5TT 0.8571
359 JNW 0.8570
360 3WL 0.8568
361 G27 0.8568
362 QUE 0.8559
363 WLH 0.8553
364 5YA 0.8550
365 SNP 0.8548
366 FER 0.8543
367 A06 0.8540
368 LR8 0.8539
369 1VG 0.8535
370 TFX 0.8522
371 MBE 0.8515
372 2ZI 0.8511
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 3UXH; Ligand: FAD; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 1) in the query (biounit: 3uxh.bio1) has 87 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 3UXH; Ligand: UXH; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 2) in the query (biounit: 3uxh.bio1) has 86 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 3; Query (leader) PDB : 3UXH; Ligand: UXH; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 3) in the query (biounit: 3uxh.bio1) has 87 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 4; Query (leader) PDB : 3UXH; Ligand: FAD; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 4) in the query (biounit: 3uxh.bio1) has 86 residues
No: Leader PDB Ligand Sequence Similarity
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