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- PDB : .ZIP | .CSV
- Family 90% : .ZIP | .CSV
- Class : .ZIP | .CSV
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 44 families. | |||||
1 | 5CPZ | - | GAL NGA GAL SIA SIA | n/a | n/a |
2 | 5CPW | - | GAL SIA NGA GAL SIA SIA | n/a | n/a |
3 | 5CQ0 | - | GAL NGA GAL SIA | n/a | n/a |
4 | 5CPY | - | GAL NGA GAL SIA | n/a | n/a |
5 | 1VPS | - | NAG GAL SIA SIA | n/a | n/a |
6 | 5CPX | - | NAG GAL SIA | n/a | n/a |
7 | 4U60 | - | BGC GAL SIA NGA GAL | n/a | n/a |
8 | 6HKV | - | GXB | C92 H139 N19 O39 | CC(=O)NCCN.... |
9 | 4U62 | - | SIA | C11 H19 N O9 | CC(=O)N[C@.... |
10 | 4U61 | - | GAL SIA | n/a | n/a |
11 | 6HKU | - | GLC GAL SIA | n/a | n/a |
12 | 4POR | - | BGC GAL SIA | n/a | n/a |
13 | 4POS | - | NAG GAL SIA | n/a | n/a |
14 | 4POT | - | NAG GAL NGC | n/a | n/a |
15 | 4MJ0 | - | SIA SIA | n/a | n/a |
16 | 3NXD | - | BGC GAL NAG GAL SIA | n/a | n/a |
17 | 4X16 | - | SIA | C11 H19 N O9 | CC(=O)N[C@.... |
18 | 4X15 | - | BGC GAL SIA NGA | n/a | n/a |
19 | 4X10 | - | GAL SIA NGA | n/a | n/a |
20 | 4X0Z | - | BGC GAL SIA NGA GAL | n/a | n/a |
21 | 4X17 | - | SIA SIA | n/a | n/a |
22 | 4JCF | - | NAG GAL SIA | n/a | n/a |
23 | 4X12 | - | SIA SIA | n/a | n/a |
24 | 4X14 | - | BGC GAL SIA NGA GAL | n/a | n/a |
25 | 4X11 | - | SIA | C11 H19 N O9 | CC(=O)N[C@.... |
26 | 4X13 | - | BGC GAL NAG GAL SIA | n/a | n/a |
27 | 4MBY | - | GAL SIA | n/a | n/a |
28 | 4MBZ | - | GAL SIA | n/a | n/a |
29 | 4FMI | - | NAG GAL SIA | n/a | n/a |
30 | 4FMJ | - | SIA | C11 H19 N O9 | CC(=O)N[C@.... |
31 | 4FMH | - | GAL SIA | n/a | n/a |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 36 families. | |||||
1 | 5CPZ | - | GAL NGA GAL SIA SIA | n/a | n/a |
2 | 5CPW | - | GAL SIA NGA GAL SIA SIA | n/a | n/a |
3 | 5CQ0 | - | GAL NGA GAL SIA | n/a | n/a |
4 | 5CPY | - | GAL NGA GAL SIA | n/a | n/a |
5 | 1VPS | - | NAG GAL SIA SIA | n/a | n/a |
6 | 5CPX | - | NAG GAL SIA | n/a | n/a |
7 | 4U60 | - | BGC GAL SIA NGA GAL | n/a | n/a |
8 | 6HKV | - | GXB | C92 H139 N19 O39 | CC(=O)NCCN.... |
9 | 4U62 | - | SIA | C11 H19 N O9 | CC(=O)N[C@.... |
10 | 4U61 | - | GAL SIA | n/a | n/a |
11 | 6HKU | - | GLC GAL SIA | n/a | n/a |
12 | 3BWR | Kd ~ 3 mM | BGC GAL SIA NGA GAL | n/a | n/a |
13 | 4POR | - | BGC GAL SIA | n/a | n/a |
14 | 4POS | - | NAG GAL SIA | n/a | n/a |
15 | 4POT | - | NAG GAL NGC | n/a | n/a |
16 | 6Y5Y | - | BGC GAL SIA | n/a | n/a |
17 | 4MJ0 | - | SIA SIA | n/a | n/a |
18 | 6Y64 | - | GAL SIA | n/a | n/a |
19 | 3NXD | - | BGC GAL NAG GAL SIA | n/a | n/a |
20 | 4X16 | - | SIA | C11 H19 N O9 | CC(=O)N[C@.... |
21 | 4X15 | - | BGC GAL SIA NGA | n/a | n/a |
22 | 4X10 | - | GAL SIA NGA | n/a | n/a |
23 | 4X0Z | - | BGC GAL SIA NGA GAL | n/a | n/a |
24 | 4X17 | - | SIA SIA | n/a | n/a |
25 | 4JCF | - | NAG GAL SIA | n/a | n/a |
26 | 4X12 | - | SIA SIA | n/a | n/a |
27 | 4X14 | - | BGC GAL SIA NGA GAL | n/a | n/a |
28 | 4X11 | - | SIA | C11 H19 N O9 | CC(=O)N[C@.... |
29 | 4X13 | - | BGC GAL NAG GAL SIA | n/a | n/a |
30 | 4MBY | - | GAL SIA | n/a | n/a |
31 | 4MBZ | - | GAL SIA | n/a | n/a |
32 | 4FMI | - | NAG GAL SIA | n/a | n/a |
33 | 4FMJ | - | SIA | C11 H19 N O9 | CC(=O)N[C@.... |
34 | 4FMH | - | GAL SIA | n/a | n/a |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | GAL SIA | 1 | 1 |
2 | NAG SIA | 0.710843 | 0.909091 |
3 | SIA CMO | 0.635135 | 0.867925 |
4 | BGC GAL SIA | 0.608247 | 0.980392 |
5 | NDG GAL SIA SIA | 0.592233 | 0.909091 |
6 | GAL NAG GAL SIA | 0.567308 | 0.943396 |
7 | NAG GAL SIA SIA | 0.561905 | 0.943396 |
8 | MNA | 0.558442 | 0.849057 |
9 | 2FG SIA | 0.543478 | 0.890909 |
10 | SIA SIA | 0.516484 | 0.888889 |
11 | NAG GAL NAG GAL SIA | 0.513043 | 0.943396 |
12 | SLB SIA SIA SIA | 0.51087 | 0.888889 |
13 | SLB SIA SIA SIA SIA | 0.51087 | 0.888889 |
14 | SLB SIA SIA | 0.51087 | 0.888889 |
15 | SIA SIA SIA SIA SIA SIA SIA | 0.51087 | 0.888889 |
16 | GAL SIA NGA GAL | 0.509259 | 0.943396 |
17 | BGC GAL NAG GAL SIA | 0.508621 | 0.943396 |
18 | NAG GAL 5N6 | 0.504587 | 0.925926 |
19 | GAL SIA SIA | 0.5 | 0.907407 |
20 | A2G GAL SIA | 0.495146 | 0.924528 |
21 | NAG GAL SIA | 0.490385 | 0.924528 |
22 | GAL SIA NGA | 0.485714 | 0.924528 |
23 | SIA SIA SIA | 0.484536 | 0.888889 |
24 | GAL 5N6 | 0.474747 | 0.924528 |
25 | NGS GAL SIA | 0.473214 | 0.731343 |
26 | SIA GAL NGA GAL | 0.468468 | 0.924528 |
27 | GAL NGA GAL SIA | 0.468468 | 0.924528 |
28 | GAL SIA NGA GAL SIA | 0.468468 | 0.924528 |
29 | NAG FUC GAL SIA | 0.464912 | 0.924528 |
30 | NAG 2FG SIA | 0.462963 | 0.859649 |
31 | SIA | 0.4625 | 0.86 |
32 | SLB | 0.4625 | 0.86 |
33 | MBG NGC | 0.454545 | 0.90566 |
34 | NGA GAL SIA | 0.454545 | 0.90566 |
35 | CNP | 0.453488 | 0.796296 |
36 | MAG FUC GAL SIA | 0.452174 | 0.888889 |
37 | NGS FUC GLA SIA | 0.45082 | 0.731343 |
38 | WIA SIA | 0.44898 | 0.892857 |
39 | MN0 | 0.447059 | 0.849057 |
40 | NAG GAL NGC | 0.446429 | 0.924528 |
41 | GAL NAG FUC GAL SIA | 0.441667 | 0.924528 |
42 | BGC GAL SIA NAG | 0.435897 | 0.924528 |
43 | BGC GAL SIA NGA GAL SIA | 0.433333 | 0.924528 |
44 | BGC GAL SIA SIA | 0.432203 | 0.907407 |
45 | BGC GAL GLA NGA GAL SIA | 0.429752 | 0.924528 |
46 | BGC GAL SIA NGA GAL | 0.429752 | 0.924528 |
47 | SID | 0.426966 | 0.781818 |
48 | C5P SIA | 0.425 | 0.662162 |
49 | MUS | 0.423077 | 0.793103 |
50 | GAL SIA NGA GAL SIA SIA | 0.419355 | 0.907407 |
51 | NXD | 0.417582 | 0.789474 |
52 | GAL NGA GAL SIA SIA | 0.416 | 0.907407 |
53 | C4W NAG FUC BMA MAN NAG GAL SIA | 0.414286 | 0.819672 |
54 | 423 | 0.407407 | 0.636364 |
55 | 6KL | 0.406977 | 0.77193 |
56 | GLY PRO ALA THR PRO ALA PRO A2G SIA | 0.406897 | 0.724638 |
57 | NGA POL GAL NGC AZI | 0.406504 | 0.753846 |
58 | GLC GAL NGC | 0.401786 | 0.923077 |
59 | PH5 | 0.4 | 0.888889 |
60 | 425 | 0.4 | 0.636364 |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | SIA | 1 | 1 |
2 | SLB | 1 | 1 |
3 | 42D | 0.758621 | 0.875 |
4 | 18D | 0.758621 | 0.955556 |
5 | NGE | 0.754386 | 0.933333 |
6 | NGC | 0.754386 | 0.933333 |
7 | MNA | 0.629032 | 0.895833 |
8 | 79J | 0.615385 | 0.934783 |
9 | SIA CMO | 0.59375 | 0.877551 |
10 | CNP | 0.58209 | 0.875 |
11 | KDM | 0.568965 | 0.72093 |
12 | KDN | 0.568965 | 0.72093 |
13 | SIA SIA | 0.565789 | 0.826923 |
14 | SLB SIA SIA SIA SIA | 0.558442 | 0.826923 |
15 | SLB SIA SIA SIA | 0.558442 | 0.826923 |
16 | SLB SIA SIA | 0.558442 | 0.826923 |
17 | SIA SIA SIA SIA SIA SIA SIA | 0.558442 | 0.826923 |
18 | FSI | 0.515152 | 0.895833 |
19 | SFJ | 0.5 | 0.875 |
20 | 6KL | 0.5 | 0.807692 |
21 | MN0 | 0.485714 | 0.895833 |
22 | EQP | 0.470588 | 0.788462 |
23 | AXP | 0.470588 | 0.788462 |
24 | GAL SIA | 0.4625 | 0.86 |
25 | SID | 0.459459 | 0.82 |
26 | SIA SIA SIA | 0.453488 | 0.826923 |
27 | MUS | 0.449438 | 0.796296 |
28 | NXD | 0.447368 | 0.792453 |
29 | WIA SIA | 0.447059 | 0.767857 |
30 | 2FG SIA | 0.447059 | 0.796296 |
31 | KDO | 0.435484 | 0.704545 |
32 | NAG SIA | 0.430233 | 0.781818 |
33 | BND | 0.416667 | 0.807692 |
34 | SKD | 0.414286 | 0.875 |
35 | GAL SIA SIA | 0.410526 | 0.811321 |
36 | E3M | 0.402778 | 0.606061 |
37 | 4AM | 0.4 | 0.833333 |
38 | DAN | 0.4 | 0.911111 |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | SIA GAL | 0.9514 |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | 49A | 0.9738 |
2 | 9AM | 0.9671 |
3 | DF4 | 0.9637 |
4 | G28 | 0.9369 |
5 | GC9 | 0.9014 |
6 | G39 | 0.8962 |
7 | 9GW | 0.8947 |
8 | 0HX | 0.8920 |
9 | ST5 | 0.8919 |
10 | 9GT | 0.8895 |
11 | K99 | 0.8872 |
12 | ZMR | 0.8860 |
13 | 2H8 | 0.8805 |
14 | ST4 | 0.8777 |
15 | R2D | 0.8751 |
16 | 5M8 | 0.8749 |
17 | 9GN | 0.8727 |
18 | 9GQ | 0.8684 |
19 | NG1 | 0.8662 |
20 | KFN | 0.8658 |
21 | 9GZ | 0.8646 |
22 | ST6 | 0.8636 |
23 | LNV | 0.8630 |
24 | FID | 0.8627 |
25 | HBQ | 0.8617 |
26 | GYG | 0.8600 |
27 | RP6 | 0.8554 |
This union binding pocket(no: 1) in the query (biounit: 4u60.bio1) has 11 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 4u60.bio1) has 15 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 3) in the query (biounit: 4u60.bio1) has 14 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 4) in the query (biounit: 4u60.bio1) has 11 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |