Receptor
PDB id Resolution Class Description Source Keywords
4u7g 1.96 Å EC: 1.10.5.1 OXIDIZED QUINONE REDUCTASE 2 IN COMPLEX WITH CK2 INHIBITOR T HOMO SAPIENS QUINONE REDUCTASE 2 CK2 INHIBITOR OXIDOREDUCTASE-INHIBITOR
Ref.: QUINONE REDUCTASE 2 IS AN ADVENTITIOUS TARGET OF PR KINASE CK2 INHIBITORS TBBZ (TBI) AND DMAT. BIOCHEMISTRY V. 54 47 2015
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
FAD A:302;
B:302;
 Valid;
Valid;
 none;
none;
 submit data
785.55 C27 H33 N9 O15 P2 Cc1cc...
K17 B:303;
A:303;
 Valid;
Valid;
 Atoms found MORE than expected: % Diff = 2;
Atoms found MORE than expected: % Diff = 2;
 Kd = 18.1 nM
433.72 C7 H2 Br4 N2 c1[nH...
ZN A:301;
B:301;
 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: K17; Similar ligands found: 1
No: Ligand ECFP6 Tc MDL keys Tc
1 K17 1 1
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: K17; Similar ligands found: 758
No: Ligand Similarity coefficient
1 TBS 1.0000
2 K8X 0.9987
3 K32 0.9795
4 PHH 0.9750
5 TEP 0.9716
6 K6X 0.9686
7 K22 0.9679
8 BSP 0.9675
9 BGC 0.9651
10 QWW 0.9646
11 GIM 0.9639
12 QX2 0.9631
13 AEZ 0.9595
14 G3F 0.9571
15 NTZ 0.9570
16 HTP 0.9530
17 LI6 0.9529
18 8S0 0.9516
19 209 0.9513
20 ISE 0.9502
21 MT5 0.9493
22 9KT 0.9489
23 RPQ 0.9484
24 CFF 0.9476
25 H33 0.9469
26 GLC 0.9460
27 GCS 0.9443
28 NDM 0.9436
29 BDP 0.9425
30 3MG 0.9416
31 CTS 0.9402
32 LGC 0.9401
33 MVL 0.9395
34 PFB 0.9383
35 QWN 0.9379
36 PCI 0.9370
37 VK3 0.9366
38 HQD 0.9355
39 0CU 0.9352
40 IBF 0.9348
41 B57 0.9342
42 QXW 0.9340
43 ASO 0.9336
44 SHG 0.9333
45 GCW 0.9330
46 AZ9 0.9322
47 NQ 0.9322
48 DQN 0.9303
49 PBR 0.9300
50 DMD 0.9299
51 4AA 0.9297
52 KBG 0.9293
53 F3B 0.9292
54 6GU 0.9291
55 YH7 0.9290
56 680 0.9290
57 X05 0.9289
58 BBF 0.9287
59 BCP 0.9282
60 TTL 0.9282
61 GCU 0.9281
62 NOJ 0.9281
63 K37 0.9279
64 BCF 0.9278
65 INS 0.9273
66 1XM 0.9268
67 DX4 0.9262
68 CFP 0.9257
69 HH5 0.9252
70 0N7 0.9248
71 HFB 0.9244
72 HHA 0.9243
73 MT0 0.9243
74 6AP 0.9242
75 RXA 0.9238
76 BOA 0.9237
77 A2F 0.9232
78 2ZV 0.9230
79 GUN 0.9225
80 HJP 0.9224
81 67N 0.9220
82 BNT 0.9220
83 GAL 0.9220
84 G2F 0.9219
85 XAN 0.9219
86 9DG 0.9218
87 SKA 0.9216
88 AZG 0.9213
89 HQT 0.9212
90 KJY 0.9210
91 6F0 0.9209
92 X09 0.9208
93 GCB 0.9206
94 GRE 0.9201
95 7W1 0.9200
96 JBQ 0.9199
97 M1A 0.9199
98 CLZ 0.9197
99 5QX 0.9196
100 3ID 0.9194
101 G6D 0.9191
102 HZQ 0.9191
103 AZA 0.9190
104 141 0.9190
105 ADK 0.9189
106 NOY 0.9188
107 3HA 0.9188
108 KJH 0.9186
109 290 0.9182
110 G5V 0.9182
111 DIU 0.9182
112 UEG 0.9182
113 G1O 0.9179
114 42C 0.9178
115 3WA 0.9178
116 IGA 0.9176
117 M5K 0.9169
118 AJ2 0.9169
119 GIO 0.9168
120 DPZ 0.9167
121 37T 0.9161
122 IFL 0.9161
123 3M0 0.9158
124 PXL 0.9155
125 EVA 0.9155
126 3F0 0.9153
127 PE0 0.9153
128 Q24 0.9149
129 BEA 0.9149
130 5JQ 0.9147
131 2H5 0.9146
132 6M1 0.9142
133 M6N 0.9142
134 FDB 0.9140
135 4HC 0.9139
136 JUG 0.9139
137 75K 0.9139
138 C2U 0.9137
139 12Q 0.9137
140 AZ8 0.9136
141 JU2 0.9135
142 IV2 0.9134
143 MEW 0.9133
144 JBK 0.9133
145 INE 0.9129
146 25W 0.9129
147 3PF 0.9129
148 DBH 0.9126
149 XYP 0.9124
150 ZVO 0.9123
151 URC 0.9122
152 5WY 0.9121
153 FE DB1 0.9120
154 12B 0.9116
155 06B 0.9115
156 B60 0.9112
157 AQO 0.9112
158 CN0 0.9111
159 PYQ 0.9110
160 XAZ 0.9106
161 7VJ 0.9105
162 82I 0.9103
163 2ZQ 0.9100
164 Q6T 0.9099
165 PQ0 0.9097
166 DBJ 0.9096
167 AKH 0.9095
168 HNQ 0.9095
169 MAQ 0.9094
170 495 0.9092
171 HLZ 0.9089
172 KIF 0.9088
173 7B3 0.9088
174 TOF 0.9087
175 B55 0.9086
176 QBK 0.9085
177 QSH 0.9085
178 3MA 0.9080
179 R8V 0.9080
180 QPR 0.9077
181 J5I 0.9072
182 MAN 0.9072
183 G3E 0.9069
184 6VD 0.9068
185 UNC 0.9068
186 LXC 0.9067
187 SYA 0.9066
188 BTY 0.9064
189 M1Q 0.9063
190 UQ 0.9063
191 7NI 0.9060
192 FOT 0.9060
193 IJZ 0.9058
194 EQT 0.9055
195 NID 0.9053
196 2FQ 0.9053
197 39A 0.9051
198 6RQ 0.9050
199 GLA 0.9047
200 5SG 0.9045
201 D48 0.9045
202 7ZE 0.9045
203 MO8 0.9044
204 5QY 0.9044
205 SE2 0.9043
206 9MG 0.9041
207 2AK 0.9039
208 VNL 0.9034
209 GOX 0.9031
210 B53 0.9030
211 5WV 0.9026
212 5JL 0.9024
213 SOE 0.9023
214 EA1 0.9019
215 HQY 0.9018
216 2D0 0.9016
217 M1H 0.9016
218 5NU 0.9010
219 329 0.9009
220 SJ5 0.9007
221 EXO 0.9006
222 1NP 0.9005
223 KKN 0.9005
224 7W4 0.9004
225 GCV 0.8999
226 8XQ 0.8998
227 0FN 0.8998
228 BMA 0.8997
229 7VS 0.8995
230 8TX 0.8994
231 F5B 0.8993
232 TTY 0.8992
233 PRF 0.8992
234 3FH 0.8992
235 32X 0.8989
236 4ME 0.8989
237 8IG 0.8986
238 O72 0.8985
239 0P6 0.8985
240 NGO 0.8984
241 DHQ 0.8982
242 M0Q 0.8981
243 4M0 0.8980
244 24W 0.8979
245 GLT 0.8977
246 ES0 0.8976
247 ES1 0.8974
248 7B4 0.8973
249 GTR 0.8972
250 8NY 0.8972
251 LT2 0.8969
252 ES9 0.8968
253 9PY 0.8968
254 PXM 0.8968
255 J9W 0.8967
256 0W8 0.8967
257 5Q0 0.8967
258 ES7 0.8966
259 XQG 0.8965
260 SOR 0.8964
261 KYD 0.8964
262 UAN 0.8964
263 OA3 0.8964
264 H4N 0.8964
265 KIB 0.8963
266 KIA 0.8963
267 ADE 0.8962
268 LKA 0.8961
269 MUA 0.8961
270 DRL 0.8960
271 SYV 0.8959
272 RM1 0.8959
273 FK1 0.8958
274 HPA 0.8956
275 3RK 0.8956
276 FA0 0.8956
277 X8D 0.8954
278 APZ 0.8953
279 ISN 0.8953
280 F81 0.8952
281 WOO 0.8952
282 FLV 0.8951
283 226 0.8951
284 1LQ 0.8950
285 4XH 0.8950
286 FDK 0.8947
287 HH8 0.8946
288 1P8 0.8944
289 FH2 0.8944
290 5WX 0.8944
291 11S 0.8943
292 7WA 0.8942
293 BZX 0.8942
294 ES5 0.8941
295 CLW 0.8941
296 KT7 0.8941
297 1XN 0.8940
298 PX7 0.8939
299 5CU 0.8938
300 SVN 0.8938
301 5IQ 0.8936
302 JXN 0.8936
303 4FS 0.8935
304 VGD 0.8934
305 10L 0.8933
306 Q88 0.8933
307 XHP 0.8933
308 BHA 0.8931
309 JPZ 0.8930
310 JB5 0.8930
311 DOB 0.8929
312 03V 0.8928
313 A7W 0.8928
314 5CL 0.8927
315 5OB 0.8926
316 8CM 0.8926
317 1SQ 0.8926
318 6AI 0.8925
319 5MB 0.8925
320 1U6 0.8925
321 YIO 0.8924
322 CWM 0.8924
323 4YS 0.8924
324 BZ3 0.8923
325 2AQ 0.8921
326 1WD 0.8921
327 ADA 0.8919
328 F60 0.8919
329 7WV 0.8918
330 N5J 0.8914
331 H42 0.8914
332 36R 0.8912
333 COU 0.8912
334 5MI 0.8911
335 2K4 0.8911
336 D07 0.8910
337 ADZ 0.8910
338 FGZ 0.8909
339 AHR 0.8907
340 IFM 0.8907
341 JKE 0.8907
342 5RO 0.8907
343 4XS 0.8907
344 DIN 0.8907
345 GYE 0.8904
346 BP1 0.8903
347 BTE 0.8902
348 5B1 0.8901
349 4MU 0.8900
350 6MP 0.8900
351 SWA 0.8898
352 Z5P 0.8897
353 6BL 0.8895
354 OCH 0.8894
355 B62 0.8894
356 14O 0.8893
357 FBG 0.8892
358 PM6 0.8891
359 GTZ 0.8890
360 ES4 0.8890
361 JBE 0.8889
362 SAL 0.8885
363 4XV 0.8885
364 G12 0.8885
365 GSY 0.8884
366 0JD 0.8884
367 XQ0 0.8884
368 9HX 0.8884
369 ES2 0.8883
370 9DA 0.8882
371 CWS 0.8882
372 AJV 0.8880
373 1P7 0.8878
374 7HP 0.8877
375 QX4 0.8876
376 GXY 0.8874
377 44V 0.8874
378 BE2 0.8874
379 OTW 0.8872
380 P9P 0.8872
381 XXR 0.8871
382 H5B 0.8868
383 23A 0.8867
384 3DM 0.8867
385 MYJ 0.8866
386 86J 0.8865
387 5XC 0.8865
388 5M0 0.8865
389 1GN 0.8864
390 2HQ 0.8863
391 F9Y 0.8863
392 ODO 0.8861
393 6CS 0.8861
394 5H1 0.8861
395 4SV 0.8860
396 44W 0.8859
397 MR1 0.8859
398 5RG 0.8856
399 YSO 0.8856
400 ZWZ 0.8855
401 MS9 0.8854
402 6ME 0.8853
403 3IT 0.8853
404 4JT 0.8852
405 FBT 0.8852
406 7ME 0.8850
407 0FO 0.8848
408 5VM 0.8848
409 GDE 0.8845
410 OXZ 0.8844
411 5GU 0.8843
412 DNA 0.8842
413 DQU 0.8841
414 3U4 0.8840
415 2FG 0.8840
416 JLZ 0.8838
417 XX2 0.8838
418 4NC 0.8838
419 KUF 0.8837
420 2CQ 0.8837
421 XYS 0.8835
422 O2A 0.8835
423 GOG 0.8835
424 6M9 0.8835
425 1LM 0.8834
426 FUL 0.8834
427 JBH 0.8832
428 ET2 0.8832
429 GTQ 0.8832
430 CTL 0.8831
431 K3Q 0.8831
432 MXX 0.8830
433 IHB 0.8829
434 GAF 0.8828
435 1DW 0.8827
436 7WR 0.8825
437 JFD 0.8825
438 DNC 0.8822
439 LZM 0.8821
440 7HQ 0.8821
441 MRW 0.8819
442 GIV 0.8819
443 45C 0.8818
444 I3A 0.8817
445 DFB 0.8816
446 ZB1 0.8816
447 CHB 0.8815
448 54G 0.8815
449 I1N 0.8815
450 MZB 0.8814
451 KYA 0.8813
452 3HM 0.8813
453 8ZE 0.8812
454 QSB 0.8811
455 9TW 0.8809
456 ICO 0.8809
457 ES6 0.8806
458 DHK 0.8805
459 42A 0.8803
460 F12 0.8801
461 E3D 0.8800
462 N2I 0.8799
463 RNS 0.8798
464 IPB 0.8797
465 4A3 0.8796
466 BK9 0.8796
467 FHB 0.8795
468 9TZ 0.8795
469 SHA 0.8795
470 93K 0.8794
471 E7Z 0.8793
472 DMJ 0.8793
473 JAE 0.8791
474 HIS 0.8791
475 18N 0.8790
476 I6G 0.8790
477 5RN 0.8790
478 PRZ 0.8789
479 INO 0.8788
480 2KA 0.8788
481 149 0.8788
482 M2K 0.8788
483 EJZ 0.8786
484 DHB 0.8785
485 8WO 0.8784
486 3Z8 0.8781
487 J9Q 0.8780
488 D3M 0.8778
489 7MH 0.8778
490 K25 0.8777
491 5MK 0.8777
492 SWD 0.8777
493 MVN 0.8776
494 JTH 0.8773
495 NAG 0.8773
496 FDR 0.8773
497 4Z4 0.8773
498 JIF 0.8771
499 HX3 0.8771
500 2CK 0.8770
501 KJU 0.8770
502 NDH 0.8770
503 NNO 0.8770
504 1KP 0.8770
505 JKZ 0.8765
506 GT0 0.8763
507 QUZ 0.8763
508 0RW 0.8763
509 F05 0.8762
510 2HO 0.8761
511 NPY 0.8761
512 6M4 0.8761
513 GZL 0.8760
514 FYU 0.8760
515 JXW 0.8760
516 X6X 0.8759
517 1X7 0.8756
518 PDC 0.8756
519 AMG 0.8755
520 RM4 0.8754
521 9EW 0.8753
522 DGJ 0.8751
523 39O 0.8750
524 GV9 0.8750
525 DIE 0.8748
526 4HM 0.8748
527 UFO 0.8747
528 ZYR 0.8747
529 SX1 0.8747
530 BDF 0.8746
531 F0J 0.8741
532 JYB 0.8740
533 F31 0.8739
534 K5W 0.8739
535 8W9 0.8739
536 3Z7 0.8738
537 2LY 0.8738
538 NMJ 0.8738
539 JA8 0.8737
540 MBG 0.8734
541 270 0.8734
542 TWO 0.8733
543 2EC 0.8730
544 FUF 0.8730
545 W81 0.8730
546 582 0.8729
547 RAM 0.8727
548 LDR 0.8726
549 M1E 0.8726
550 4TU 0.8726
551 GXL 0.8726
552 KFH 0.8726
553 9LI 0.8725
554 HMU 0.8724
555 97T 0.8723
556 OXC 0.8722
557 QAT 0.8722
558 TC7 0.8721
559 PQK 0.8721
560 DNF 0.8720
561 TFU 0.8719
562 150 0.8719
563 IFP 0.8718
564 HXX 0.8716
565 AIN 0.8715
566 HMH 0.8715
567 1WG 0.8713
568 9FL 0.8711
569 4YO 0.8710
570 GF4 0.8710
571 QAS 0.8709
572 KDV 0.8709
573 9AP 0.8708
574 0TU 0.8705
575 DOR 0.8705
576 NDG 0.8704
577 XQK 0.8704
578 T6C 0.8703
579 BPU 0.8702
580 CWJ 0.8701
581 4CS 0.8700
582 ORO 0.8700
583 K2T 0.8699
584 PEY 0.8698
585 GM7 0.8698
586 4RU 0.8697
587 0F9 0.8696
588 15E 0.8696
589 FRU 0.8695
590 NTM 0.8695
591 8GC 0.8694
592 WCE 0.8693
593 4JQ 0.8692
594 RHU 0.8692
595 3NT 0.8692
596 MFU 0.8692
597 27B 0.8691
598 KGK 0.8691
599 MQN 0.8690
600 YQA 0.8689
601 GZ8 0.8687
602 GAB 0.8687
603 AX7 0.8685
604 NPO 0.8684
605 2D3 0.8684
606 ABV 0.8684
607 FBB 0.8684
608 GJS 0.8682
609 V55 0.8681
610 ARB 0.8680
611 3R6 0.8678
612 JZ9 0.8677
613 4KL 0.8675
614 S76 0.8675
615 AW5 0.8671
616 4P5 0.8671
617 F4Z 0.8668
618 MFB 0.8668
619 52C 0.8668
620 N8Y 0.8668
621 4AN 0.8665
622 8WT 0.8665
623 L7T 0.8664
624 4FH 0.8662
625 FCB 0.8661
626 8H8 0.8659
627 TH7 0.8659
628 M0W 0.8658
629 JG8 0.8656
630 3HB 0.8655
631 6NT 0.8654
632 UFV 0.8653
633 ONR 0.8653
634 AA 0.8651
635 THA 0.8651
636 GJP 0.8651
637 35C 0.8650
638 9R5 0.8648
639 3BZ 0.8646
640 KLW 0.8646
641 LSA 0.8646
642 OVV 0.8645
643 2MI 0.8641
644 2BG 0.8641
645 Q7A 0.8640
646 ZZT 0.8640
647 E7S 0.8639
648 PHT 0.8637
649 OVM 0.8636
650 1HN 0.8635
651 BRT 0.8635
652 3MB 0.8633
653 SKM 0.8632
654 HLR 0.8632
655 5HN 0.8630
656 DEN 0.8629
657 XM0 0.8627
658 IDM 0.8627
659 IND 0.8627
660 HLD 0.8627
661 92P 0.8622
662 NSP 0.8622
663 3XX 0.8621
664 28N 0.8621
665 BRV 0.8621
666 K44 0.8621
667 3NY 0.8620
668 OW4 0.8619
669 0CT 0.8618
670 9CA 0.8618
671 P3K 0.8614
672 3AB 0.8614
673 1IT 0.8612
674 4JP 0.8610
675 BZI 0.8609
676 EUG 0.8608
677 4M4 0.8608
678 C2Y 0.8607
679 0HN 0.8606
680 ANF 0.8605
681 TSS 0.8605
682 ABI 0.8604
683 TBP 0.8603
684 BZJ 0.8602
685 HKD 0.8599
686 43M 0.8599
687 0MK 0.8597
688 FCA 0.8596
689 P92 0.8596
690 LZ1 0.8596
691 BA5 0.8594
692 X0V 0.8594
693 AZF 0.8594
694 3SK 0.8593
695 MPI 0.8593
696 0R1 0.8592
697 PHB 0.8592
698 FUC 0.8591
699 IBM 0.8590
700 BZF 0.8588
701 MMA 0.8588
702 MT8 0.8587
703 2ZM 0.8585
704 AC6 0.8585
705 TH0 0.8585
706 SXS 0.8584
707 0HO 0.8583
708 E7R 0.8582
709 GVH 0.8581
710 23J 0.8581
711 EKZ 0.8580
712 KOJ 0.8575
713 FSW 0.8574
714 1F1 0.8573
715 24B 0.8571
716 3QV 0.8569
717 8MO 0.8569
718 FB1 0.8569
719 2HU 0.8566
720 JAW 0.8564
721 5NI 0.8564
722 I3C 0.8564
723 HHR 0.8564
724 5UC 0.8562
725 PH2 0.8561
726 6NI 0.8561
727 0XT 0.8558
728 E1K 0.8558
729 PYG 0.8558
730 BHO 0.8554
731 ZZ3 0.8553
732 XBZ 0.8553
733 HQJ 0.8552
734 FUD 0.8552
735 4JO 0.8551
736 53C 0.8550
737 OVP 0.8547
738 URF 0.8544
739 GCO 0.8541
740 3C1 0.8540
741 15N 0.8539
742 GAG 0.8539
743 TDR 0.8538
744 DBX 0.8532
745 SRO 0.8530
746 8HC 0.8530
747 261 0.8527
748 HBD 0.8527
749 PBZ 0.8524
750 GNM 0.8522
751 EYK 0.8522
752 1PT 0.8522
753 275 0.8521
754 AY4 0.8519
755 IUR 0.8519
756 A13 0.8510
757 3CE 0.8509
758 WBU 0.8507
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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