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No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 426 families. | |||||
1 | 3VD8 | - | GLC GLC GLC GLC | n/a | n/a |
2 | 6ANV | - | GLC GLC GLC GLC | n/a | n/a |
3 | 3JYR | Kd = 2.9 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 | 6YBK | Ki = 5 nM | OK2 | C40 H38 Cl F N6 O5 S | Cc1c(ccc(c.... |
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 | Kd = 93 uM | 3R4 | C9 H4 Cl F O2 S | c1cc2c(cc1.... |
64 | 6YBL | Ki = 0.029 nM | OK5 | C47 H44 Cl F N6 O6 S | Cc1c(ccc(c.... |
65 | 4WMW | - | 3R6 | C8 H8 O3 S | CSc1ccc(c(.... |
66 | 4WMS | - | GLC GLC | n/a | n/a |
67 | 6QYL | - | JLE | C25 H22 N4 O2 S | CCc1c(c2c(.... |
68 | 6QYN | - | GLC GLC | n/a | n/a |
69 | 5LOF | Kd = 0.19 nM | 70R | C39 H37 Cl F4 N6 O6 S | Cc1c(ccc(c.... |
70 | 6YBJ | Ki = 0.86 nM | OJW | C38 H38 Cl F N6 O6 S | Cc1c(ccc(c.... |
71 | 4WMU | Kd = 0.18 uM | 19H | C20 H19 Cl2 N O3 | Cc1cc(cc(c.... |
72 | 6QYK | - | GLC GLC | n/a | n/a |
73 | 6QGD | - | J1N | C17 H17 N3 O3 S | CCc1c(c2c(.... |
74 | 5OSQ | - | GLC GLC | n/a | n/a |
75 | 3D4G | - | 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 | 3OAI | - | GLC GLC | n/a | n/a |
87 | 5TTD | - | GLC GLC GLC | n/a | n/a |
88 | 4KYD | - | GLC GLC | n/a | n/a |
89 | 5JST | - | GLC GLC | n/a | n/a |
90 | 2XZ3 | - | GLC GLC | n/a | n/a |
91 | 3N94 | - | GLC GLC | n/a | n/a |
92 | 4XZS | - | GLC GLC | n/a | n/a |
93 | 5H7N | - | GLC GLC GLC GLC | n/a | n/a |
94 | 4PE2 | - | GLC GLC | n/a | n/a |
95 | 4TSM | - | GLC GLC GLC GLC | n/a | n/a |
96 | 4IKM | - | GLC GLC | n/a | n/a |
97 | 1Y4C | - | GLC GLC | n/a | n/a |
98 | 6WBH | - | GLC GLC | n/a | n/a |
99 | 6WBJ | - | GLC GLC | n/a | n/a |
100 | 5C7R | - | GLC GLC GLC | n/a | n/a |
101 | 5DFM | - | GLC GLC | n/a | n/a |
102 | 4IRL | - | GLC GLC GLC GLC | n/a | n/a |
103 | 1MG1 | - | GLC GLC | n/a | n/a |
104 | 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 322 families. | |||||
1 | 3VD8 | - | GLC GLC GLC GLC | n/a | n/a |
2 | 6ANV | - | GLC GLC GLC GLC | n/a | n/a |
3 | 3JYR | Kd = 2.9 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 | 6YBK | Ki = 5 nM | OK2 | C40 H38 Cl F N6 O5 S | Cc1c(ccc(c.... |
60 | 6QYO | - | GLC GLC | n/a | n/a |
61 | 6QZ7 | - | JLE | C25 H22 N4 O2 S | CCc1c(c2c(.... |
62 | 6QXJ | - | GLC GLC | n/a | n/a |
63 | 4WMX | Kd = 14.1 uM | 3R7 | C15 H13 N O4 S | C=Cc1ccc(c.... |
64 | 4WMV | Kd = 93 uM | 3R4 | C9 H4 Cl F O2 S | c1cc2c(cc1.... |
65 | 6YBL | Ki = 0.029 nM | OK5 | C47 H44 Cl F N6 O6 S | Cc1c(ccc(c.... |
66 | 4WMW | - | 3R6 | C8 H8 O3 S | CSc1ccc(c(.... |
67 | 4WMS | - | GLC GLC | n/a | n/a |
68 | 6QYL | - | JLE | C25 H22 N4 O2 S | CCc1c(c2c(.... |
69 | 6QYN | - | GLC GLC | n/a | n/a |
70 | 5LOF | Kd = 0.19 nM | 70R | C39 H37 Cl F4 N6 O6 S | Cc1c(ccc(c.... |
71 | 6YBJ | Ki = 0.86 nM | OJW | C38 H38 Cl F N6 O6 S | Cc1c(ccc(c.... |
72 | 4WMU | Kd = 0.18 uM | 19H | C20 H19 Cl2 N O3 | Cc1cc(cc(c.... |
73 | 6QYK | - | GLC GLC | n/a | n/a |
74 | 6QGD | - | J1N | C17 H17 N3 O3 S | CCc1c(c2c(.... |
75 | 5OSQ | - | GLC GLC | n/a | n/a |
76 | 3D4G | - | GLC GLC | n/a | n/a |
77 | 4WVH | - | GLC GLC | n/a | n/a |
78 | 4WVG | - | GLC GLC | n/a | n/a |
79 | 4WTH | - | GLC GLC | n/a | n/a |
80 | 4YS9 | - | GLC GLC | n/a | n/a |
81 | 4MY2 | - | GLC GLC | n/a | n/a |
82 | 4KYC | - | GLC GLC | n/a | n/a |
83 | 1HSJ | - | GLC GLC | n/a | n/a |
84 | 5HZ7 | - | BGC | C6 H12 O6 | C([C@@H]1[.... |
85 | 3H4Z | - | GLC GLC | n/a | n/a |
86 | 5WPZ | - | GLC GLC | n/a | n/a |
87 | 5WQ6 | - | GLC GLC | n/a | n/a |
88 | 5H7Q | - | GLC GLC | n/a | n/a |
89 | 3DM0 | - | GLC GLC | n/a | n/a |
90 | 3OAI | - | GLC GLC | n/a | n/a |
91 | 5TTD | - | GLC GLC GLC | n/a | n/a |
92 | 4KYD | - | GLC GLC | n/a | n/a |
93 | 5JST | - | GLC GLC | n/a | n/a |
94 | 2XZ3 | - | GLC GLC | n/a | n/a |
95 | 3N94 | - | GLC GLC | n/a | n/a |
96 | 4QVH | - | FLC | C6 H5 O7 | C(C(=O)[O-.... |
97 | 4XZS | - | GLC GLC | n/a | n/a |
98 | 5H7N | - | GLC GLC GLC GLC | n/a | n/a |
99 | 4PE2 | - | GLC GLC | n/a | n/a |
100 | 3O3U | - | GLC GLC GLC | n/a | n/a |
101 | 4TSM | - | GLC GLC GLC GLC | n/a | n/a |
102 | 4IKM | - | GLC GLC | n/a | n/a |
103 | 1Y4C | - | GLC GLC | n/a | n/a |
104 | 6WBH | - | GLC GLC | n/a | n/a |
105 | 6WBJ | - | GLC GLC | n/a | n/a |
106 | 5T05 | - | A3P | C10 H15 N5 O10 P2 | c1nc(c2c(n.... |
107 | 5T0A | - | A3P | C10 H15 N5 O10 P2 | c1nc(c2c(n.... |
108 | 5T03 | - | A3P | C10 H15 N5 O10 P2 | c1nc(c2c(n.... |
109 | 5C7R | - | GLC GLC GLC | n/a | n/a |
110 | 5DFM | - | GLC GLC | n/a | n/a |
111 | 4IRL | - | GLC GLC GLC GLC | n/a | n/a |
112 | 1MG1 | - | GLC GLC | n/a | n/a |
113 | 5AZ7 | - | GLC GLC | n/a | n/a |
114 | 6ZIS | - | 3N6 | C38 H47 Br2 N9 O5 | c1ccc2c(c1.... |
115 | 6ZHO | - | QLQ | C40 H49 N11 O5 | Cc1cc(cc2c.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | GLC GLC AC1 | 1 | 1 |
2 | GLC GLC GLC GLC BGC GLC GLC | 0.637931 | 0.744186 |
3 | MAN BMA BMA BMA BMA BMA BMA | 0.637931 | 0.744186 |
4 | BGC BGC BGC BGC BGC BGC BGC BGC BGC | 0.637931 | 0.744186 |
5 | BGC GLC AGL GLC HMC AGL | 0.614458 | 0.875 |
6 | G4D G4D G4D G4D G4D G4D G4D G4D G4D G4D G4D | 0.569231 | 0.727273 |
7 | GLC AGL | 0.555556 | 0.911111 |
8 | BMA BMA BMA BMA | 0.552239 | 0.744186 |
9 | BGC BGC BGC BGC BGC BGC BGC BGC | 0.552239 | 0.744186 |
10 | GLC GLC GLC GLC GLC | 0.542857 | 0.744186 |
11 | BGC GLC GLC GLC | 0.542857 | 0.744186 |
12 | GAL GLC GLD ACI | 0.538462 | 0.933333 |
13 | GLC GAL BGC FUC | 0.536232 | 0.767442 |
14 | BGC GAL FUC | 0.536232 | 0.767442 |
15 | BMA BMA BMA BMA GLA | 0.535211 | 0.744186 |
16 | GLC GLC GLC GLC GLC GLC GLC GLC GLC | 0.535211 | 0.744186 |
17 | TXT | 0.531646 | 0.888889 |
18 | BGC GLC AGL GLC GLC GLC | 0.531646 | 0.913043 |
19 | BGC GAL NGA | 0.520548 | 0.851064 |
20 | GLC GLC GLC GLC GLC GLC AC1 | 0.512195 | 0.893617 |
21 | GLC GLC GLC AC1 | 0.512195 | 0.893617 |
22 | BGC BGC BGC XYS | 0.493506 | 0.711111 |
23 | BGC GAL NGA GAL | 0.493506 | 0.851064 |
24 | BGC GAL GLA | 0.492537 | 0.744186 |
25 | BGC GLC AC1 GLC GLC GLC AC1 | 0.488372 | 0.893617 |
26 | GLC GLC GLC G6D ACI GLC GLC | 0.488372 | 0.933333 |
27 | BGC G6D GLC ACI G6D ACI | 0.488372 | 0.893617 |
28 | GLC GLC GLC DAF DAF | 0.488372 | 0.893617 |
29 | BGC GLC GLC | 0.485714 | 0.744186 |
30 | BGC GAL FUC GLA | 0.480519 | 0.767442 |
31 | BGC Z9D | 0.476923 | 0.727273 |
32 | BGC GLA GAL | 0.47541 | 0.744186 |
33 | BGC DAF | 0.474359 | 0.933333 |
34 | BGC BGC BGC XYS BGC XYS BGC XYS BGC | 0.469136 | 0.711111 |
35 | BGC BGC BGC BGC XYS BGC XYS BGC BGC | 0.469136 | 0.711111 |
36 | BGC BGC BGC BGC BGC XYS | 0.469136 | 0.711111 |
37 | GLC AGL HMC | 0.469136 | 0.795918 |
38 | ARE | 0.466667 | 0.851064 |
39 | AAO | 0.466667 | 0.851064 |
40 | GLC GLC AGL HMC GLC | 0.466667 | 0.893617 |
41 | GLC GLC G6D GLC ACI GLC | 0.466667 | 0.893617 |
42 | BGC GLC GLD GLC ACI GLD GLC ACI G6D | 0.466667 | 0.875 |
43 | GLC GLC AC1 GLC GLC GLC | 0.466667 | 0.893617 |
44 | G2F SHG BGC BGC | 0.463768 | 0.680851 |
45 | BGC GAL GLA NGA | 0.463415 | 0.851064 |
46 | ACG | 0.461538 | 0.851064 |
47 | GLC GLC GLD GLC ACI GLD GLC ACI GLD ACI | 0.461538 | 0.857143 |
48 | GLC AC1 GLC AC1 | 0.461538 | 0.857143 |
49 | GLC GLC G6D GLC ACI G6D ACI | 0.461538 | 0.857143 |
50 | BGC GAL GLA NGA GAL | 0.457831 | 0.851064 |
51 | 7SA | 0.456522 | 0.816327 |
52 | BGC BGC BGC XYS BGC XYS | 0.444444 | 0.711111 |
53 | MAN BMA BMA | 0.442857 | 0.711111 |
54 | GLC BGC G6D ACI | 0.44186 | 0.933333 |
55 | BGC BGC BGC XYS BGC XYS XYS | 0.439024 | 0.711111 |
56 | MGL GAL | 0.430769 | 0.75 |
57 | GLC GLC AGL HMC | 0.428571 | 0.795918 |
58 | BGC BGC BGC XYS XYS GAL GAL | 0.425287 | 0.711111 |
59 | BGC FUC GAL | 0.424658 | 0.767442 |
60 | G2F BGC BGC BGC BGC BGC | 0.424658 | 0.666667 |
61 | GLC BGC FUC GAL | 0.424658 | 0.767442 |
62 | BGC 5VQ GAL GLA | 0.422535 | 0.717391 |
63 | GLC GLC G6D ACI | 0.422222 | 0.893617 |
64 | BGC GLC AC1 GLC AC1 | 0.42 | 0.823529 |
65 | BGC GLC DAF GLC GLC GLC DAF | 0.42 | 0.823529 |
66 | FUC GAL | 0.41791 | 0.744186 |
67 | BGC BGC BGC XYS BGC XYS GAL | 0.41573 | 0.711111 |
68 | BGC GAL NAG GAL FUC | 0.413043 | 0.833333 |
69 | GLC GLC FRU | 0.4125 | 0.666667 |
70 | BGC GAL FUC A2G | 0.411111 | 0.833333 |
71 | GTM BGC BGC GDA | 0.409639 | 0.893617 |
72 | BGC GAL NAG GAL | 0.409639 | 0.851064 |
73 | MGL SGC | 0.405797 | 0.702128 |
74 | GLF B8D | 0.405797 | 0.666667 |
75 | GLC NBU GAL GLA | 0.405405 | 0.6875 |
76 | BGC GAL NAG | 0.402439 | 0.851064 |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | GLC GLC GLC GLC | 0.9642 |
2 | GLC GLC DAF | 0.8669 |
This union binding pocket(no: 1) in the query (biounit: 3jyr.bio1) has 20 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |