- Navigate
- Expand All | Collapse All
- Receptor | Ligand | View in 3D
- Family: 90% | 70% | 50% | site
- External Links
- |
- Download
- Structure Biounit | Ligand Information
- 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 67 families. | |||||
1 | 6ULN | - | GLY ALA ASP GLY VAL GLY LYS SER ALA | n/a | n/a |
2 | 2P5E | - | SER LEU LEU MET TRP ILE THR GLN CYS | n/a | n/a |
3 | 2BNQ | Kd = 5 uM | SER LEU LEU MET TRP ILE THR GLN VAL | n/a | n/a |
4 | 2BNR | Kd = 13.3 uM | SER LEU LEU MET TRP ILE THR GLN CYS | n/a | n/a |
5 | 2PYE | - | SER LEU LEU MET TRP ILE THR GLN CYS | n/a | n/a |
6 | 2P5W | - | SER LEU LEU MET TRP ILE THR GLN CYS | n/a | n/a |
7 | 3VXM | - | ARG PHE PRO LEU THR PHE GLY TRP CYS PHE | n/a | n/a |
8 | 5JZI | - | LYS LEU VAL ALA LEU GLY ILE ASN ALA VAL | n/a | n/a |
9 | 5HHM | - | GLY ILE LEU GLY LEU VAL PHE THR LEU | n/a | n/a |
10 | 2VLK | - | GLY ILE LEU GLY PHE VAL PHE THR LEU | n/a | n/a |
11 | 2VLJ | - | GLY ILE LEU GLY PHE VAL PHE THR LEU | n/a | n/a |
12 | 1OGA | - | GLY ILE LEU GLY PHE VAL PHE THR LEU | n/a | n/a |
13 | 2VLR | - | GLY ILE LEU GLY PHE VAL PHE THR LEU | n/a | n/a |
14 | 5ISZ | Kd = 27 nM | GLY ILE LEU GLY PHE VAL PHE THR LEU | n/a | n/a |
15 | 3QFJ | - | LEU LEU PHE GLY PHE PRO VAL TYR VAL | n/a | n/a |
16 | 5EU6 | - | TYR LEU GLU PRO GLY PRO VAL THR VAL | n/a | n/a |
17 | 1BD2 | - | LEU LEU PHE GLY TYR PRO VAL TYR VAL | n/a | n/a |
18 | 6BJ3 | Kd = 17 uM | ILE PRO LEU THR GLU GLU ALA GLU LEU | n/a | n/a |
19 | 5C0B | - | ARG GLN PHE GLY PRO ASP PHE PRO THR ILE | n/a | n/a |
20 | 5C07 | - | TYR GLN PHE GLY PRO ASP PHE PRO ILE ALA | n/a | n/a |
21 | 5C0C | - | ARG GLN PHE GLY PRO ASP TRP ILE VAL ALA | n/a | n/a |
22 | 6TMO | Kd = 0.75 nM | GLU ALA ALA GLY ILE GLY ILE LEU THR VAL | n/a | n/a |
23 | 4JFF | Kd = 600 pM | GLU LEU ALA GLY ILE GLY ILE LEU THR VAL | n/a | n/a |
24 | 4JFD | Kd = 36 uM | GLU LEU ALA ALA ILE GLY ILE LEU THR VAL | n/a | n/a |
25 | 5BS0 | Kd = 76.7 nM | GLU SER ASP PRO ILE VAL ALA GLN TYR | n/a | n/a |
26 | 6D78 | - | ALA ALA GLY ILE GLY ILE LEU THR VAL | n/a | n/a |
27 | 3QDJ | - | ALA ALA GLY ILE GLY ILE LEU THR VAL | n/a | n/a |
28 | 1MI5 | Kd ~ 10 uM | PHE LEU ARG GLY ARG ALA TYR GLY LEU | n/a | n/a |
29 | 3VXS | - | ARG TYR PRO LEU THR LEU GLY TRP CYS PHE | n/a | n/a |
30 | 3VXR | - | ARG TYR PRO LEU THR PHE GLY TRP CYS PHE | n/a | n/a |
31 | 4G9F | - | LYS ARG TRP ILE ILE MET GLY LEU ASN LYS | n/a | n/a |
32 | 4G8G | - | LYS ARG TRP ILE ILE LEU GLY LEU ASN LYS | n/a | n/a |
33 | 6VRN | - | HIS MET THR GLU VAL VAL ARG HIS CYS | n/a | n/a |
34 | 6RPB | - | SER LEU LEU MET TRP ILE THR GLN VAL | n/a | n/a |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 45 families. | |||||
1 | 6ULN | - | GLY ALA ASP GLY VAL GLY LYS SER ALA | n/a | n/a |
2 | 2F53 | - | SER LEU LEU MET TRP ILE THR GLN CYS | n/a | n/a |
3 | 2P5E | - | SER LEU LEU MET TRP ILE THR GLN CYS | n/a | n/a |
4 | 2BNQ | Kd = 5 uM | SER LEU LEU MET TRP ILE THR GLN VAL | n/a | n/a |
5 | 2BNR | Kd = 13.3 uM | SER LEU LEU MET TRP ILE THR GLN CYS | n/a | n/a |
6 | 2PYE | - | SER LEU LEU MET TRP ILE THR GLN CYS | n/a | n/a |
7 | 2P5W | - | SER LEU LEU MET TRP ILE THR GLN CYS | n/a | n/a |
8 | 3VXM | - | ARG PHE PRO LEU THR PHE GLY TRP CYS PHE | n/a | n/a |
9 | 5JZI | - | LYS LEU VAL ALA LEU GLY ILE ASN ALA VAL | n/a | n/a |
10 | 5HHM | - | GLY ILE LEU GLY LEU VAL PHE THR LEU | n/a | n/a |
11 | 2VLK | - | GLY ILE LEU GLY PHE VAL PHE THR LEU | n/a | n/a |
12 | 2VLJ | - | GLY ILE LEU GLY PHE VAL PHE THR LEU | n/a | n/a |
13 | 1OGA | - | GLY ILE LEU GLY PHE VAL PHE THR LEU | n/a | n/a |
14 | 2VLR | - | GLY ILE LEU GLY PHE VAL PHE THR LEU | n/a | n/a |
15 | 5ISZ | Kd = 27 nM | GLY ILE LEU GLY PHE VAL PHE THR LEU | n/a | n/a |
16 | 3QFJ | - | LEU LEU PHE GLY PHE PRO VAL TYR VAL | n/a | n/a |
17 | 5IVX | Kd ~ 0.54 uM | ARG GLY PRO GLY ARG ALA PHE VAL THR ILE | n/a | n/a |
18 | 5EU6 | - | TYR LEU GLU PRO GLY PRO VAL THR VAL | n/a | n/a |
19 | 1BD2 | - | LEU LEU PHE GLY TYR PRO VAL TYR VAL | n/a | n/a |
20 | 6BJ8 | - | VAL PRO LEU THR GLU ASP ALA GLU LEU | n/a | n/a |
21 | 6BJ3 | Kd = 17 uM | ILE PRO LEU THR GLU GLU ALA GLU LEU | n/a | n/a |
22 | 5JHD | Kd = 37 nM | GLY ILE LEU GLY PHE VAL PHE THR LEU | n/a | n/a |
23 | 2JCC | - | ALA LEU TRP GLY PHE PHE PRO VAL LEU | n/a | n/a |
24 | 2UWE | - | ALA LEU TRP GLY PHE PHE PRO VAL LEU | n/a | n/a |
25 | 1LP9 | - | ALA LEU TRP GLY PHE PHE PRO VAL LEU | n/a | n/a |
26 | 5C09 | - | TYR LEU GLY GLY PRO ASP PHE PRO THR ILE | n/a | n/a |
27 | 5C0A | - | MET VAL TRP GLY PRO ASP PRO LEU TYR VAL | n/a | n/a |
28 | 5C08 | - | ARG GLN TRP GLY PRO ASP PRO ALA ALA VAL | n/a | n/a |
29 | 5C0B | - | ARG GLN PHE GLY PRO ASP PHE PRO THR ILE | n/a | n/a |
30 | 5C07 | - | TYR GLN PHE GLY PRO ASP PHE PRO ILE ALA | n/a | n/a |
31 | 5C0C | - | ARG GLN PHE GLY PRO ASP TRP ILE VAL ALA | n/a | n/a |
32 | 6TMO | Kd = 0.75 nM | GLU ALA ALA GLY ILE GLY ILE LEU THR VAL | n/a | n/a |
33 | 4JFF | Kd = 600 pM | GLU LEU ALA GLY ILE GLY ILE LEU THR VAL | n/a | n/a |
34 | 4JFD | Kd = 36 uM | GLU LEU ALA ALA ILE GLY ILE LEU THR VAL | n/a | n/a |
35 | 5BS0 | Kd = 76.7 nM | GLU SER ASP PRO ILE VAL ALA GLN TYR | n/a | n/a |
36 | 6D78 | - | ALA ALA GLY ILE GLY ILE LEU THR VAL | n/a | n/a |
37 | 3QDJ | - | ALA ALA GLY ILE GLY ILE LEU THR VAL | n/a | n/a |
38 | 1MI5 | Kd ~ 10 uM | PHE LEU ARG GLY ARG ALA TYR GLY LEU | n/a | n/a |
39 | 3VXS | - | ARG TYR PRO LEU THR LEU GLY TRP CYS PHE | n/a | n/a |
40 | 3VXR | - | ARG TYR PRO LEU THR PHE GLY TRP CYS PHE | n/a | n/a |
41 | 1MWA | - | GLU GLN TYR LYS PHE TYR SER VAL | n/a | n/a |
42 | 4G9F | - | LYS ARG TRP ILE ILE MET GLY LEU ASN LYS | n/a | n/a |
43 | 4G8G | - | LYS ARG TRP ILE ILE LEU GLY LEU ASN LYS | n/a | n/a |
44 | 6VRN | - | HIS MET THR GLU VAL VAL ARG HIS CYS | n/a | n/a |
45 | 6PVD | Kd = 200 uM | N18 | C9 H11 N3 O5 | COC(=O)CCN.... |
46 | 4NQD | - | 2LJ | C12 H20 N4 O6 | CC/C=N/C1=.... |
47 | 4LCW | - | 1VY | C12 H16 N4 O7 | CC1=C(N(C2.... |
48 | 4L4V | Kd = 1.65 uM | 1VY | C12 H16 N4 O7 | CC1=C(N(C2.... |
49 | 6PVC | Kd = 172 uM | P1J | C8 H9 N3 O5 | C1=C(NC(=O.... |
50 | 6RPB | - | SER LEU LEU MET TRP ILE THR GLN VAL | n/a | n/a |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | AE4 | 1 | 1 |
2 | PE4 | 1 | 1 |
3 | PE5 | 1 | 1 |
4 | FWN | 1 | 0.961538 |
5 | 7PE | 1 | 1 |
6 | P4K | 1 | 1 |
7 | AE3 | 0.954545 | 0.923077 |
8 | 2PE | 0.681818 | 0.814815 |
9 | 33O | 0.681818 | 0.814815 |
10 | PE8 | 0.681818 | 0.814815 |
11 | PG4 | 0.681818 | 0.777778 |
12 | P33 | 0.681818 | 0.814815 |
13 | PE3 | 0.681818 | 0.814815 |
14 | 12P | 0.681818 | 0.814815 |
15 | 16P | 0.681818 | 0.814815 |
16 | P6G | 0.681818 | 0.814815 |
17 | XPE | 0.681818 | 0.814815 |
18 | 1PE | 0.681818 | 0.814815 |
19 | P3G | 0.681818 | 0.777778 |
20 | P4G | 0.681818 | 0.740741 |
21 | PGE | 0.636364 | 0.777778 |
22 | ETX | 0.608696 | 0.807692 |
23 | P15 | 0.571429 | 0.857143 |
24 | TOE | 0.571429 | 0.821429 |
25 | 1PG | 0.571429 | 0.857143 |
26 | PEU | 0.571429 | 0.857143 |
27 | 15P | 0.571429 | 0.857143 |
28 | 7PG | 0.571429 | 0.857143 |
29 | ETE | 0.571429 | 0.821429 |
30 | PEG | 0.545455 | 0.740741 |
31 | PGF | 0.535714 | 0.724138 |
32 | ME2 | 0.535714 | 0.689655 |
33 | PE7 | 0.517241 | 0.785714 |
34 | CE9 | 0.514286 | 0.962963 |
35 | N8E | 0.514286 | 0.962963 |
36 | 32M | 0.514286 | 0.962963 |
37 | CE1 | 0.514286 | 0.962963 |
38 | C8E | 0.514286 | 0.962963 |
39 | C10 | 0.514286 | 0.962963 |
40 | PG0 | 0.5 | 0.785714 |
41 | P4C | 0.454545 | 0.814815 |
42 | OP2 | 0.441176 | 0.758621 |
43 | 2NV | 0.441176 | 0.657143 |
44 | TEG | 0.411765 | 0.724138 |
No: | Ligand | Similarity coefficient |
---|
No: | Ligand | Similarity coefficient |
---|