- 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 5 families. | |||||
1 | 2VMO | - | GLY PLP | n/a | n/a |
2 | 2VMQ | - | GLY PLP | n/a | n/a |
3 | 2W7F | - | SER PLP | n/a | n/a |
4 | 2W7L | - | PLP ALO | n/a | n/a |
5 | 1KKP | - | PLP SER | n/a | n/a |
6 | 2VMP | - | SER PLP | n/a | n/a |
7 | 1YJY | - | PLP SER | n/a | n/a |
8 | 2VMW | - | SER PLP | n/a | n/a |
9 | 2W7K | - | SER PLP | n/a | n/a |
10 | 1KL1 | - | PLP GLY | n/a | n/a |
11 | 2W7J | - | GLY PLP | n/a | n/a |
12 | 2W7M | - | GLY PLP | n/a | n/a |
13 | 2VMX | - | PLP ALO | n/a | n/a |
14 | 1YJZ | - | PLP | C8 H10 N O6 P | Cc1c(c(c(c.... |
15 | 2VMT | - | SER PLP | n/a | n/a |
16 | 2W7G | - | PLP ALO | n/a | n/a |
17 | 1YJS | - | PLP GLY | n/a | n/a |
18 | 4WXG | - | 2BO | C12 H19 N2 O8 P | Cc1c(c(c(c.... |
19 | 4WXB | - | CIT | C6 H8 O7 | C(C(=O)O)C.... |
20 | 4WXF | - | PLG | C10 H15 N2 O7 P | Cc1c(c(c(c.... |
21 | 6YMF | - | PLS | C11 H17 N2 O8 P | Cc1c(c(c(c.... |
22 | 1DFO | - | PLG | C10 H15 N2 O7 P | Cc1c(c(c(c.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 3 families. | |||||
1 | 2VMO | - | GLY PLP | n/a | n/a |
2 | 2VMQ | - | GLY PLP | n/a | n/a |
3 | 2W7F | - | SER PLP | n/a | n/a |
4 | 2W7L | - | PLP ALO | n/a | n/a |
5 | 1KKP | - | PLP SER | n/a | n/a |
6 | 2VMP | - | SER PLP | n/a | n/a |
7 | 1YJY | - | PLP SER | n/a | n/a |
8 | 2VMW | - | SER PLP | n/a | n/a |
9 | 2W7K | - | SER PLP | n/a | n/a |
10 | 1KL1 | - | PLP GLY | n/a | n/a |
11 | 2W7J | - | GLY PLP | n/a | n/a |
12 | 2W7M | - | GLY PLP | n/a | n/a |
13 | 2VMX | - | PLP ALO | n/a | n/a |
14 | 1YJZ | - | PLP | C8 H10 N O6 P | Cc1c(c(c(c.... |
15 | 2VMT | - | SER PLP | n/a | n/a |
16 | 2W7G | - | PLP ALO | n/a | n/a |
17 | 1YJS | - | PLP GLY | n/a | n/a |
18 | 6UXI | - | PLG | C10 H15 N2 O7 P | Cc1c(c(c(c.... |
19 | 6UXL | - | PLG | C10 H15 N2 O7 P | Cc1c(c(c(c.... |
20 | 6UXJ | Kd = 17 uM | FFO | C20 H23 N7 O7 | c1cc(ccc1C.... |
21 | 4WXG | - | 2BO | C12 H19 N2 O8 P | Cc1c(c(c(c.... |
22 | 4WXB | - | CIT | C6 H8 O7 | C(C(=O)O)C.... |
23 | 4WXF | - | PLG | C10 H15 N2 O7 P | Cc1c(c(c(c.... |
24 | 6SMW | Ki = 119.4 uM | LYA | C20 H21 N5 O6 | c1cc(ccc1C.... |
25 | 6SMR | Ki = 179.3 uM | MTX | C20 H22 N8 O5 | CN(Cc1cnc2.... |
26 | 6YMF | - | PLS | C11 H17 N2 O8 P | Cc1c(c(c(c.... |
27 | 6QVL | - | 4DW | C20 H19 N5 O6 | c1cc(ccc1C.... |
28 | 6QVG | - | GLY | C2 H5 N O2 | C(C(=O)O)N |
29 | 5V7I | - | GLY | C2 H5 N O2 | C(C(=O)O)N |
30 | 5GVN | ic50 = 90 nM | G6F | C26 H25 F N4 O3 | Cc1c2c(n[n.... |
31 | 5XMV | - | 8AU | C24 H20 Cl F3 N4 O | Cc1c2c(n[n.... |
32 | 5YFZ | - | 8UO | C24 H28 F N5 O3 | Cc1c2c(n[n.... |
33 | 5XMQ | - | 8A6 | C32 H30 F3 N5 O3 S | Cc1c2c(n[n.... |
34 | 4TN4 | - | 33G | C25 H20 F N5 O | Cc1c2c(n[n.... |
35 | 5GVL | ic50 = 42 nM | GI8 | C24 H23 N5 O2 S | Cc1c2c(n[n.... |
36 | 5XMP | - | 8A3 | C27 H25 F6 N5 O3 S | Cc1c2c(n[n.... |
37 | 5GVM | ic50 = 186 nM | G57 | C26 H23 F3 N4 O3 | Cc1c2c(n[n.... |
38 | 5XMS | - | 8B3 | C24 H20 F4 N4 O | Cc1c2c(n[n.... |
39 | 5YG4 | - | 8UF | C25 H28 F N5 O3 | Cc1c2c(n[n.... |
40 | 5XMU | - | 8A0 | C25 H23 F3 N4 O | Cc1ccccc1c.... |
41 | 5YG3 | - | 8UC | C23 H20 F N5 O | Cc1c2c(n[n.... |
42 | 5GVK | ic50 = 99 nM | G45 | C24 H24 N6 O3 S2 | Cc1c2c(n[n.... |
43 | 5YG2 | - | N05 | C25 H30 F N5 O3 | Cc1c2c(n[n.... |
44 | 5GVP | ic50 = 165 nM | GCF | C27 H25 F3 N4 O3 | Cc1c2c(n[n.... |
45 | 1DFO | - | PLG | C10 H15 N2 O7 P | Cc1c(c(c(c.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | SER PLP | 1 | 1 |
2 | PLP ALO | 0.704225 | 0.943396 |
3 | PLP PHE | 0.701299 | 0.907407 |
4 | PLP 999 | 0.694444 | 0.943396 |
5 | KOU | 0.671429 | 0.910714 |
6 | PLP PVH | 0.646341 | 0.78125 |
7 | GLY PLP | 0.633803 | 0.888889 |
8 | PLP ABU | 0.584416 | 0.875 |
9 | PL6 | 0.571429 | 0.827586 |
10 | PLP MYB | 0.564706 | 0.731343 |
11 | PL5 | 0.548781 | 0.786885 |
12 | F0G | 0.546667 | 0.839286 |
13 | PLP PUT | 0.538462 | 0.8 |
14 | EPC | 0.534247 | 0.803571 |
15 | PUS | 0.53012 | 0.746269 |
16 | P70 | 0.53012 | 0.842105 |
17 | EQJ | 0.529412 | 0.793651 |
18 | 5DK | 0.529412 | 0.793651 |
19 | 6DF | 0.5125 | 0.758621 |
20 | FEJ | 0.506173 | 0.827586 |
21 | PLP 142 | 0.494624 | 0.78125 |
22 | EVM | 0.493671 | 0.928571 |
23 | 4LM | 0.493506 | 0.79661 |
24 | 0JO | 0.493506 | 0.813559 |
25 | Q0P | 0.483516 | 0.774194 |
26 | PLT | 0.473118 | 0.774194 |
27 | FEV | 0.4625 | 0.783333 |
28 | Z98 | 0.452381 | 0.790323 |
29 | EXT | 0.448718 | 0.810345 |
30 | ASP PLP | 0.440476 | 0.824561 |
31 | HCP | 0.439024 | 0.754098 |
32 | MPM | 0.432099 | 0.793103 |
33 | PLP SER | 0.432099 | 0.786885 |
34 | PLP | 0.422535 | 0.781818 |
35 | P3D | 0.421687 | 0.746032 |
36 | P89 | 0.417582 | 0.701493 |
37 | PLP CYS | 0.416667 | 0.790323 |
38 | PZP | 0.416667 | 0.754386 |
39 | FOO | 0.4125 | 0.793103 |
40 | PLP 2TL | 0.411765 | 0.803279 |
41 | SEP PLP | 0.406977 | 0.833333 |
42 | PLP BH2 | 0.406977 | 0.803279 |
43 | PLP PMP | 0.405405 | 0.762712 |
44 | LEU PLP | 0.402299 | 0.777778 |
45 | AN7 | 0.4 | 0.754386 |
46 | PLP 2KZ | 0.4 | 0.786885 |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | PLS | 0.9965 |
2 | P1T | 0.9672 |
3 | 2BO | 0.9592 |
4 | C6P | 0.9590 |
5 | PLG | 0.9582 |
6 | PDA | 0.9544 |
7 | 2BK | 0.9505 |
8 | TLP | 0.9495 |
9 | CKT | 0.9431 |
10 | PLI | 0.9405 |
11 | PP3 | 0.9405 |
12 | PDD | 0.9355 |
13 | PLP GLY | 0.9309 |
14 | 5PA | 0.9300 |
15 | IN5 | 0.9298 |
16 | DCS | 0.9266 |
17 | 7TS | 0.9230 |
18 | PLP MET | 0.9135 |
19 | MET PLP | 0.9132 |
20 | L7N | 0.9097 |
21 | IK2 | 0.9085 |
22 | LCS | 0.9073 |
23 | PPD | 0.9017 |
24 | PM9 | 0.8996 |
25 | PLP 2ML | 0.8993 |
26 | PY5 | 0.8964 |
27 | PMH | 0.8946 |
28 | ILP | 0.8939 |
29 | PLA | 0.8936 |
30 | KET | 0.8897 |
31 | 7XF | 0.8851 |
32 | OJQ | 0.8846 |
33 | 3QP | 0.8843 |
34 | 3LM | 0.8787 |
35 | PLP 0A0 | 0.8787 |
36 | PGU | 0.8744 |
37 | 07U | 0.8737 |
38 | PPE | 0.8704 |
39 | 8JF | 0.8696 |
40 | PLP SEP | 0.8636 |
41 | P19 | 0.8561 |