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No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 420 families. | |||||
1 | 3VD8 | - | GLC GLC GLC GLC | n/a | n/a |
2 | 6ANV | - | GLC GLC GLC GLC | n/a | n/a |
3 | 3JYR | Kd = 248 uM | GLC GLC AC1 | n/a | n/a |
4 | 4IFP | - | GLC GLC | n/a | n/a |
5 | 3SET | - | GLC GLC | n/a | n/a |
6 | 3SEY | - | GLC GLC | n/a | n/a |
7 | 5B3Y | - | GLC GLC | n/a | n/a |
8 | 1JW5 | - | GLC GLC | n/a | n/a |
9 | 3Q29 | - | GLC GLC | n/a | n/a |
10 | 1FQC | - | GLO GLC GLC | n/a | n/a |
11 | 5ZCA | - | GLC GLC | n/a | n/a |
12 | 1ANF | Ki = 3.5 uM | GLC GLC | n/a | n/a |
13 | 3MBP | Ki = 0.16 uM | GLC GLC GLC | n/a | n/a |
14 | 1DMB | Kd = 1.8 uM | GLC GLC GLC GLC GLC GLC GLC | n/a | n/a |
15 | 1FQB | - | SOR GLC GLC | n/a | n/a |
16 | 3SEU | - | GLC GLC | n/a | n/a |
17 | 6EQZ | - | GLC GLC | n/a | n/a |
18 | 5B3X | - | GLC GLC | n/a | n/a |
19 | 3G7W | - | GLC GLC GLC | n/a | n/a |
20 | 3Q26 | - | GLC GLC | n/a | n/a |
21 | 4MBP | Ki = 2.3 uM | GLC GLC GLC GLC | n/a | n/a |
22 | 1FQD | - | GLO GLC GLC GLC | n/a | n/a |
23 | 5MM3 | - | GLC GLC | n/a | n/a |
24 | 3Q25 | - | GLC GLC | n/a | n/a |
25 | 4JBZ | - | GLC GLC | n/a | n/a |
26 | 3SER | - | GLC GLC | n/a | n/a |
27 | 1LAX | Kd = 2 uM | GLC GLC | n/a | n/a |
28 | 6N84 | - | GLC GLC | n/a | n/a |
29 | 3SES | - | GLC GLC | n/a | n/a |
30 | 1MDP | - | GLC GLC | n/a | n/a |
31 | 1MDQ | - | GLC GLC | n/a | n/a |
32 | 3SEX | - | GLC GLC | n/a | n/a |
33 | 1JVX | - | GLC GLC | n/a | n/a |
34 | 5B3Z | - | GLC GLC | n/a | n/a |
35 | 1NL5 | Kd = 6 nM | GLC GLC | n/a | n/a |
36 | 3G7V | - | GLC GLC | n/a | n/a |
37 | 3RUM | - | GLC GLC | n/a | n/a |
38 | 1JVY | - | GLC GLC | n/a | n/a |
39 | 3Q28 | - | GLC GLC | n/a | n/a |
40 | 3SEW | - | GLC GLC | n/a | n/a |
41 | 3LBS | - | GLC GLC | n/a | n/a |
42 | 1EZ9 | Kd = 8 uM | GLO GLC GLC GLC | n/a | n/a |
43 | 3Q27 | - | GLC GLC | n/a | n/a |
44 | 5BMY | - | GLC GLC | n/a | n/a |
45 | 1FQA | - | SOR GLC GLC GLC | n/a | n/a |
46 | 1MPD | - | GLC GLC | n/a | n/a |
47 | 4RG5 | - | GLC GLC | n/a | n/a |
48 | 3HPI | Kd = 6.6 uM | GLC FRU | n/a | n/a |
49 | 5B3W | - | GLC GLC | n/a | n/a |
50 | 2VGQ | - | GLC GLC GLC GLC | n/a | n/a |
51 | 5IHJ | - | GLC GLC GLC | n/a | n/a |
52 | 5CFV | - | GLC GLC | n/a | n/a |
53 | 5II5 | - | GLC GLC | n/a | n/a |
54 | 5II4 | - | GLC GLC | n/a | n/a |
55 | 5IQZ | - | GLC GLC | n/a | n/a |
56 | 4WMT | - | 865 | C37 H36 N6 O4 | Cc1ccnc(c1.... |
57 | 4WGI | - | 3M6 | C30 H30 F4 N4 O7 S | C[C@@H]1CN.... |
58 | 6QYO | - | GLC GLC | n/a | n/a |
59 | 6QZ7 | - | JLE | C25 H22 N4 O2 S | CCc1c(c2c(.... |
60 | 6QXJ | - | GLC GLC | n/a | n/a |
61 | 4WMX | Kd = 14.1 uM | 3R7 | C15 H13 N O4 S | C=Cc1ccc(c.... |
62 | 4WMV | ic50 = 93 uM | 3R4 | C9 H4 Cl F O2 S | c1cc2c(cc1.... |
63 | 4WMW | - | 3R6 | C8 H8 O3 S | CSc1ccc(c(.... |
64 | 4WMS | - | GLC GLC | n/a | n/a |
65 | 6QYL | - | JLE | C25 H22 N4 O2 S | CCc1c(c2c(.... |
66 | 6QYN | - | GLC GLC | n/a | n/a |
67 | 5LOF | Kd = 0.19 nM | 70R | C39 H37 Cl F4 N6 O6 S | Cc1c(ccc(c.... |
68 | 4WMU | Kd = 0.18 uM | 19H | C20 H19 Cl2 N O3 | Cc1cc(cc(c.... |
69 | 6QYK | - | GLC GLC | n/a | n/a |
70 | 6QGD | - | J1N | C17 H17 N3 O3 S | CCc1c(c2c(.... |
71 | 5OSQ | - | GLC GLC | n/a | n/a |
72 | 3D4G | - | GLC GLC | n/a | n/a |
73 | 4WTH | - | GLC GLC | n/a | n/a |
74 | 4YS9 | - | GLC GLC | n/a | n/a |
75 | 4MY2 | - | GLC GLC | n/a | n/a |
76 | 4KYC | - | GLC GLC | n/a | n/a |
77 | 1HSJ | - | GLC GLC | n/a | n/a |
78 | 5HZ7 | - | BGC | C6 H12 O6 | C([C@@H]1[.... |
79 | 3H4Z | - | GLC GLC | n/a | n/a |
80 | 5WPZ | - | GLC GLC | n/a | n/a |
81 | 5WQ6 | - | GLC GLC | n/a | n/a |
82 | 5H7Q | - | GLC GLC | n/a | n/a |
83 | 3OAI | - | GLC GLC | n/a | n/a |
84 | 5TTD | - | GLC GLC GLC | n/a | n/a |
85 | 4KYD | - | GLC GLC | n/a | n/a |
86 | 5JST | - | GLC GLC | n/a | n/a |
87 | 2XZ3 | - | GLC GLC | n/a | n/a |
88 | 3N94 | - | GLC GLC | n/a | n/a |
89 | 4XZS | - | GLC GLC | n/a | n/a |
90 | 5H7N | - | GLC GLC GLC GLC | n/a | n/a |
91 | 4PE2 | - | GLC GLC | n/a | n/a |
92 | 4TSM | - | GLC GLC GLC GLC | n/a | n/a |
93 | 4IKM | - | GLC GLC | n/a | n/a |
94 | 1Y4C | - | GLC GLC | n/a | n/a |
95 | 5C7R | - | GLC GLC GLC | n/a | n/a |
96 | 5DFM | - | GLC GLC | n/a | n/a |
97 | 4IRL | - | GLC GLC GLC GLC | n/a | n/a |
98 | 1MG1 | - | GLC GLC | n/a | n/a |
99 | 5AZ7 | - | GLC GLC | n/a | n/a |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 319 families. | |||||
1 | 3VD8 | - | GLC GLC GLC GLC | n/a | n/a |
2 | 6ANV | - | GLC GLC GLC GLC | n/a | n/a |
3 | 3JYR | Kd = 248 uM | GLC GLC AC1 | n/a | n/a |
4 | 4IFP | - | GLC GLC | n/a | n/a |
5 | 5I04 | - | GLC GLC | n/a | n/a |
6 | 3SET | - | GLC GLC | n/a | n/a |
7 | 3SEY | - | GLC GLC | n/a | n/a |
8 | 5B3Y | - | GLC GLC | n/a | n/a |
9 | 1JW5 | - | GLC GLC | n/a | n/a |
10 | 3Q29 | - | GLC GLC | n/a | n/a |
11 | 1FQC | - | GLO GLC GLC | n/a | n/a |
12 | 5ZCA | - | GLC GLC | n/a | n/a |
13 | 1ANF | Ki = 3.5 uM | GLC GLC | n/a | n/a |
14 | 3MBP | Ki = 0.16 uM | GLC GLC GLC | n/a | n/a |
15 | 1DMB | Kd = 1.8 uM | GLC GLC GLC GLC GLC GLC GLC | n/a | n/a |
16 | 1FQB | - | SOR GLC GLC | n/a | n/a |
17 | 3SEU | - | GLC GLC | n/a | n/a |
18 | 6EQZ | - | GLC GLC | n/a | n/a |
19 | 5B3X | - | GLC GLC | n/a | n/a |
20 | 3G7W | - | GLC GLC GLC | n/a | n/a |
21 | 3Q26 | - | GLC GLC | n/a | n/a |
22 | 4MBP | Ki = 2.3 uM | GLC GLC GLC GLC | n/a | n/a |
23 | 1FQD | - | GLO GLC GLC GLC | n/a | n/a |
24 | 5MM3 | - | GLC GLC | n/a | n/a |
25 | 3Q25 | - | GLC GLC | n/a | n/a |
26 | 4JBZ | - | GLC GLC | n/a | n/a |
27 | 3SER | - | GLC GLC | n/a | n/a |
28 | 1LAX | Kd = 2 uM | GLC GLC | n/a | n/a |
29 | 6N84 | - | GLC GLC | n/a | n/a |
30 | 3SES | - | GLC GLC | n/a | n/a |
31 | 1MDP | - | GLC GLC | n/a | n/a |
32 | 1MDQ | - | GLC GLC | n/a | n/a |
33 | 3SEX | - | GLC GLC | n/a | n/a |
34 | 1JVX | - | GLC GLC | n/a | n/a |
35 | 5B3Z | - | GLC GLC | n/a | n/a |
36 | 1NL5 | Kd = 6 nM | GLC GLC | n/a | n/a |
37 | 3G7V | - | GLC GLC | n/a | n/a |
38 | 3RUM | - | GLC GLC | n/a | n/a |
39 | 1JVY | - | GLC GLC | n/a | n/a |
40 | 3Q28 | - | GLC GLC | n/a | n/a |
41 | 3SEW | - | GLC GLC | n/a | n/a |
42 | 3LBS | - | GLC GLC | n/a | n/a |
43 | 1EZ9 | Kd = 8 uM | GLO GLC GLC GLC | n/a | n/a |
44 | 3Q27 | - | GLC GLC | n/a | n/a |
45 | 5BMY | - | GLC GLC | n/a | n/a |
46 | 1FQA | - | SOR GLC GLC GLC | n/a | n/a |
47 | 1MPD | - | GLC GLC | n/a | n/a |
48 | 4RG5 | - | GLC GLC | n/a | n/a |
49 | 3HPI | Kd = 6.6 uM | GLC FRU | n/a | n/a |
50 | 5B3W | - | GLC GLC | n/a | n/a |
51 | 2VGQ | - | GLC GLC GLC GLC | n/a | n/a |
52 | 5IHJ | - | GLC GLC GLC | n/a | n/a |
53 | 5CFV | - | GLC GLC | n/a | n/a |
54 | 5II5 | - | GLC GLC | n/a | n/a |
55 | 5II4 | - | GLC GLC | n/a | n/a |
56 | 5IQZ | - | GLC GLC | n/a | n/a |
57 | 4WMT | - | 865 | C37 H36 N6 O4 | Cc1ccnc(c1.... |
58 | 4WGI | - | 3M6 | C30 H30 F4 N4 O7 S | C[C@@H]1CN.... |
59 | 6QYO | - | GLC GLC | n/a | n/a |
60 | 6QZ7 | - | JLE | C25 H22 N4 O2 S | CCc1c(c2c(.... |
61 | 6QXJ | - | GLC GLC | n/a | n/a |
62 | 4WMX | Kd = 14.1 uM | 3R7 | C15 H13 N O4 S | C=Cc1ccc(c.... |
63 | 4WMV | ic50 = 93 uM | 3R4 | C9 H4 Cl F O2 S | c1cc2c(cc1.... |
64 | 4WMW | - | 3R6 | C8 H8 O3 S | CSc1ccc(c(.... |
65 | 4WMS | - | GLC GLC | n/a | n/a |
66 | 6QYL | - | JLE | C25 H22 N4 O2 S | CCc1c(c2c(.... |
67 | 6QYN | - | GLC GLC | n/a | n/a |
68 | 5LOF | Kd = 0.19 nM | 70R | C39 H37 Cl F4 N6 O6 S | Cc1c(ccc(c.... |
69 | 4WMU | Kd = 0.18 uM | 19H | C20 H19 Cl2 N O3 | Cc1cc(cc(c.... |
70 | 6QYK | - | GLC GLC | n/a | n/a |
71 | 6QGD | - | J1N | C17 H17 N3 O3 S | CCc1c(c2c(.... |
72 | 5OSQ | - | GLC GLC | n/a | n/a |
73 | 3D4G | - | GLC GLC | n/a | n/a |
74 | 4WVH | - | GLC GLC | n/a | n/a |
75 | 4WVG | - | GLC GLC | n/a | n/a |
76 | 4WTH | - | GLC GLC | n/a | n/a |
77 | 4YS9 | - | GLC GLC | n/a | n/a |
78 | 4MY2 | - | GLC GLC | n/a | n/a |
79 | 4KYC | - | GLC GLC | n/a | n/a |
80 | 1HSJ | - | GLC GLC | n/a | n/a |
81 | 5HZ7 | - | BGC | C6 H12 O6 | C([C@@H]1[.... |
82 | 3H4Z | - | GLC GLC | n/a | n/a |
83 | 5WPZ | - | GLC GLC | n/a | n/a |
84 | 5WQ6 | - | GLC GLC | n/a | n/a |
85 | 5H7Q | - | GLC GLC | n/a | n/a |
86 | 3DM0 | - | GLC GLC | n/a | n/a |
87 | 3OAI | - | GLC GLC | n/a | n/a |
88 | 5TTD | - | GLC GLC GLC | n/a | n/a |
89 | 4KYD | - | GLC GLC | n/a | n/a |
90 | 5JST | - | GLC GLC | n/a | n/a |
91 | 2XZ3 | - | GLC GLC | n/a | n/a |
92 | 3N94 | - | GLC GLC | n/a | n/a |
93 | 4QVH | - | FLC | C6 H5 O7 | C(C(=O)[O-.... |
94 | 4XZS | - | GLC GLC | n/a | n/a |
95 | 5H7N | - | GLC GLC GLC GLC | n/a | n/a |
96 | 4PE2 | - | GLC GLC | n/a | n/a |
97 | 3O3U | - | GLC GLC GLC | n/a | n/a |
98 | 4TSM | - | GLC GLC GLC GLC | n/a | n/a |
99 | 4IKM | - | GLC GLC | n/a | n/a |
100 | 1Y4C | - | GLC GLC | n/a | n/a |
101 | 5T05 | - | A3P | C10 H15 N5 O10 P2 | c1nc(c2c(n.... |
102 | 5T0A | - | A3P | C10 H15 N5 O10 P2 | c1nc(c2c(n.... |
103 | 5T03 | - | A3P | C10 H15 N5 O10 P2 | c1nc(c2c(n.... |
104 | 5C7R | - | GLC GLC GLC | n/a | n/a |
105 | 5DFM | - | GLC GLC | n/a | n/a |
106 | 4IRL | - | GLC GLC GLC GLC | n/a | n/a |
107 | 1MG1 | - | GLC GLC | n/a | n/a |
108 | 5AZ7 | - | GLC GLC | n/a | n/a |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | SOR GLC GLC GLC | 1 | 1 |
2 | GLO GLC GLC GLC | 1 | 1 |
3 | SOR GLC GLC | 0.965517 | 1 |
4 | GLO GLC GLC | 0.73913 | 0.971429 |
5 | GLC GLO | 0.683333 | 0.911765 |
6 | LAT GLA | 0.590164 | 0.970588 |
7 | BGC BGC GLC | 0.545455 | 0.970588 |
8 | BGC GLC GLC GLC | 0.545455 | 0.970588 |
9 | MAN BMA BMA | 0.545455 | 0.970588 |
10 | MAN BMA BMA BMA BMA BMA | 0.545455 | 0.970588 |
11 | BGC BGC BGC BGC BGC BGC BGC BGC BGC | 0.545455 | 0.970588 |
12 | BMA BMA BMA BMA BMA | 0.545455 | 0.970588 |
13 | GLC GLC GLC GLC GLC | 0.545455 | 0.970588 |
14 | BGC BGC BGC BGC | 0.545455 | 0.970588 |
15 | MTT | 0.545455 | 0.970588 |
16 | GLC BGC BGC | 0.545455 | 0.970588 |
17 | GLC GLC GLC GLC GLC GLC GLC GLC GLC | 0.545455 | 0.970588 |
18 | BGC BGC BGC GLC | 0.545455 | 0.970588 |
19 | MLR | 0.545455 | 0.970588 |
20 | CT3 | 0.545455 | 0.970588 |
21 | CE8 | 0.545455 | 0.970588 |
22 | GLC BGC BGC BGC BGC BGC | 0.545455 | 0.970588 |
23 | MT7 | 0.545455 | 0.970588 |
24 | CE6 | 0.545455 | 0.970588 |
25 | BGC GLC GLC GLC GLC GLC GLC | 0.545455 | 0.970588 |
26 | BMA MAN BMA | 0.545455 | 0.970588 |
27 | GLA GAL BGC | 0.545455 | 0.970588 |
28 | MAN MAN BMA BMA BMA BMA | 0.545455 | 0.970588 |
29 | B4G | 0.545455 | 0.970588 |
30 | GLC BGC BGC BGC BGC | 0.545455 | 0.970588 |
31 | BGC BGC BGC | 0.545455 | 0.970588 |
32 | GLA GAL GLC | 0.545455 | 0.970588 |
33 | GLC GAL GAL | 0.545455 | 0.970588 |
34 | BGC GLC GLC GLC GLC | 0.545455 | 0.970588 |
35 | CTR | 0.545455 | 0.970588 |
36 | CEX | 0.545455 | 0.970588 |
37 | MAN BMA BMA BMA BMA | 0.545455 | 0.970588 |
38 | BMA BMA BMA | 0.545455 | 0.970588 |
39 | GLC BGC GLC | 0.545455 | 0.970588 |
40 | DXI | 0.545455 | 0.970588 |
41 | GLC BGC BGC BGC | 0.545455 | 0.970588 |
42 | CEY | 0.545455 | 0.970588 |
43 | CTT | 0.545455 | 0.970588 |
44 | CE5 | 0.545455 | 0.970588 |
45 | GAL GAL GAL | 0.545455 | 0.970588 |
46 | BMA BMA BMA BMA BMA BMA | 0.545455 | 0.970588 |
47 | BGC GLC GLC | 0.545455 | 0.970588 |
48 | CEZ | 0.521127 | 0.914286 |
49 | DR5 | 0.515152 | 0.916667 |
50 | MMA MAN | 0.515152 | 0.916667 |
51 | BGC GLO | 0.507042 | 0.885714 |
52 | GLA GAL BGC 5VQ | 0.5 | 0.868421 |
53 | GAL GCO | 0.5 | 0.888889 |
54 | BGC BGC BGC FRU | 0.493333 | 0.894737 |
55 | GLA EGA | 0.492754 | 0.916667 |
56 | MAL EDO | 0.485714 | 0.971429 |
57 | BGC GAL | 0.484848 | 0.970588 |
58 | N9S | 0.484848 | 0.970588 |
59 | B2G | 0.484848 | 0.970588 |
60 | BMA BMA | 0.484848 | 0.970588 |
61 | CBI | 0.484848 | 0.970588 |
62 | GLC GAL | 0.484848 | 0.970588 |
63 | LBT | 0.484848 | 0.970588 |
64 | GAL BGC | 0.484848 | 0.970588 |
65 | MAB | 0.484848 | 0.970588 |
66 | BGC BMA | 0.484848 | 0.970588 |
67 | MAL | 0.484848 | 0.970588 |
68 | CBK | 0.484848 | 0.970588 |
69 | LAT | 0.484848 | 0.970588 |
70 | BMA GAL | 0.484848 | 0.970588 |
71 | G2F BGC BGC BGC BGC BGC | 0.48 | 0.846154 |
72 | BGC BGC BGC BGC BGC BGC BGC BGC | 0.48 | 0.970588 |
73 | GLA GAL GLC NBU | 0.48 | 0.825 |
74 | BMA BMA GLA BMA BMA | 0.468354 | 0.970588 |
75 | BMA BMA BMA GLA BMA | 0.468354 | 0.970588 |
76 | GLC GLC XYP | 0.467532 | 0.970588 |
77 | G3I | 0.467532 | 0.790698 |
78 | G2I | 0.467532 | 0.790698 |
79 | OXZ BGC BGC | 0.467532 | 0.708333 |
80 | GLO BGC BGC XYS BGC XYS XYS | 0.458333 | 0.944444 |
81 | GLC GLC XYS | 0.455696 | 0.942857 |
82 | LAG | 0.45 | 0.618182 |
83 | GLC GLC GLC BGC | 0.4375 | 0.970588 |
84 | BQZ | 0.4375 | 0.882353 |
85 | U63 | 0.43662 | 0.868421 |
86 | MVP | 0.432432 | 0.755556 |
87 | XYS BGC BGC XYS BGC XYS BGC BGC BGC | 0.431818 | 0.971429 |
88 | XYS BGC BGC BGC BGC XYS BGC BGC BGC | 0.431818 | 0.971429 |
89 | BGC BGC BGC XYS BGC BGC | 0.431818 | 0.971429 |
90 | LMU | 0.43038 | 0.767442 |
91 | DMU | 0.43038 | 0.767442 |
92 | UMQ | 0.43038 | 0.767442 |
93 | LMT | 0.43038 | 0.767442 |
94 | RCB | 0.428571 | 0.611111 |
95 | GLA GAL GAL | 0.426667 | 0.970588 |
96 | BMA MAN | 0.426471 | 0.970588 |
97 | 2M4 | 0.426471 | 0.970588 |
98 | BGC GLC | 0.426471 | 0.970588 |
99 | 4MU BGC BGC BGC BGC | 0.422222 | 0.75 |
100 | GLA GLA | 0.42029 | 0.970588 |
101 | GLA GAL | 0.42029 | 0.970588 |
102 | LB2 | 0.42029 | 0.970588 |
103 | MAN GLC | 0.42029 | 0.970588 |
104 | GLC BGC | 0.42029 | 0.970588 |
105 | NGR | 0.42029 | 0.970588 |
106 | M3M | 0.42029 | 0.970588 |
107 | GLC GLC | 0.42029 | 0.970588 |
108 | BMA BMA MAN GLA GLA | 0.417722 | 0.970588 |
109 | 6UZ | 0.414634 | 0.825 |
110 | ABD | 0.411111 | 0.733333 |
111 | 4MU BGC BGC | 0.411111 | 0.75 |
112 | TRE | 0.409836 | 0.970588 |
113 | CM5 | 0.406977 | 0.868421 |
114 | GLA MBG | 0.405797 | 0.916667 |
115 | NPJ | 0.404762 | 0.611111 |
116 | BGC BGC | 0.402778 | 0.942857 |
117 | MA4 | 0.402299 | 0.868421 |
This union binding pocket(no: 1) in the query (biounit: 1nl5.bio1) has 43 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |