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- 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 4 families. | |||||
1 | 6C4P | - | PMP | C8 H13 N2 O5 P | Cc1c(c(c(c.... |
2 | 6C2Q | - | EVM | C11 H14 N2 O8 P | Cc1c(c(c(c.... |
3 | 6C2Z | - | P1T | C11 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 4 families. | |||||
1 | 6C4P | - | PMP | C8 H13 N2 O5 P | Cc1c(c(c(c.... |
2 | 6C2Q | - | EVM | C11 H14 N2 O8 P | Cc1c(c(c(c.... |
3 | 6C2Z | - | P1T | C11 H15 N2 O7 P | Cc1c(c(c(c.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | P1T | 1 | 1 |
2 | PLG | 0.651515 | 0.890625 |
3 | HEY | 0.643836 | 0.923077 |
4 | 3LM | 0.635135 | 0.867647 |
5 | 5PA | 0.628571 | 0.878788 |
6 | PDD | 0.623188 | 0.875 |
7 | PP3 | 0.623188 | 0.875 |
8 | PDA | 0.623188 | 0.875 |
9 | IK2 | 0.614286 | 0.850746 |
10 | 2BO | 0.605634 | 0.875 |
11 | 2BK | 0.605634 | 0.875 |
12 | TLP | 0.605634 | 0.875 |
13 | PLS | 0.605634 | 0.920635 |
14 | IN5 | 0.602941 | 0.84375 |
15 | PPD | 0.597222 | 0.920635 |
16 | C6P | 0.597222 | 0.920635 |
17 | PY5 | 0.589041 | 0.865672 |
18 | PLA | 0.589041 | 0.865672 |
19 | LPI | 0.586667 | 0.828571 |
20 | PMG | 0.586667 | 0.84058 |
21 | ILP | 0.573333 | 0.848485 |
22 | 7XF | 0.573333 | 0.892308 |
23 | PGU | 0.573333 | 0.892308 |
24 | PDG | 0.573333 | 0.892308 |
25 | CBA | 0.573333 | 0.835821 |
26 | PMP | 0.571429 | 0.825397 |
27 | QLP | 0.565789 | 0.84058 |
28 | PMH | 0.561644 | 0.679487 |
29 | PY6 | 0.558442 | 0.84058 |
30 | 76U | 0.558442 | 0.850746 |
31 | PXP | 0.555556 | 0.761905 |
32 | N5F | 0.551282 | 0.878788 |
33 | EA5 | 0.551282 | 0.852941 |
34 | PSZ | 0.551282 | 0.774648 |
35 | ORX | 0.551282 | 0.878788 |
36 | PL4 | 0.55 | 0.878788 |
37 | 33P | 0.547945 | 0.80303 |
38 | CKT | 0.547945 | 0.846154 |
39 | PL2 | 0.545455 | 0.760563 |
40 | PE1 | 0.544304 | 0.878788 |
41 | GT1 | 0.538462 | 0.686567 |
42 | KAM | 0.536585 | 0.823529 |
43 | 7TS | 0.532468 | 0.753247 |
44 | PXG | 0.530864 | 0.833333 |
45 | 0PR | 0.530864 | 0.90625 |
46 | RW2 | 0.530864 | 0.909091 |
47 | DN9 | 0.53012 | 0.794521 |
48 | PLP 2KZ | 0.513158 | 0.888889 |
49 | DCS | 0.506329 | 0.74026 |
50 | AQ3 | 0.494253 | 0.865672 |
51 | PPG | 0.488095 | 0.850746 |
52 | 9YM | 0.487805 | 0.808824 |
53 | PL8 | 0.470588 | 0.833333 |
54 | RMT | 0.465116 | 0.820895 |
55 | 1D0 | 0.460674 | 0.826087 |
56 | 0JO | 0.460526 | 0.828125 |
57 | 7B9 | 0.45977 | 0.869565 |
58 | OJQ | 0.45 | 0.6625 |
59 | PLR | 0.446154 | 0.671875 |
60 | AN7 | 0.44 | 0.746032 |
61 | FOO | 0.434211 | 0.78125 |
62 | CAN PLP | 0.430233 | 0.8 |
63 | PLP | 0.426471 | 0.714286 |
64 | EVM | 0.425 | 0.787879 |
65 | 4LM | 0.423077 | 0.784615 |
66 | PZP | 0.42029 | 0.71875 |
67 | LCS | 0.416667 | 0.683544 |
68 | P0P | 0.414286 | 0.714286 |
69 | FEV | 0.4125 | 0.772727 |
70 | PLP PMP | 0.408451 | 0.78125 |
71 | Z98 | 0.404762 | 0.80597 |
72 | GAB PLP | 0.404494 | 0.791045 |
73 | 0LD | 0.4 | 0.662791 |
74 | F0G | 0.4 | 0.738462 |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | PLI | 0.9865 |
2 | GLY PLP | 0.9845 |
3 | PLP GLY | 0.9811 |
4 | PLP SER | 0.9742 |
5 | KOU | 0.9731 |
6 | SER PLP | 0.9672 |
7 | EPC | 0.9361 |
8 | PLP 2TL | 0.9249 |
9 | PLP CYS | 0.9235 |
10 | PLP ALO | 0.9233 |
11 | PM9 | 0.9111 |
12 | AKB PLP | 0.9101 |
13 | MET PLP | 0.9034 |
14 | PLP MET | 0.9024 |
15 | 07U | 0.8975 |
16 | MPM | 0.8934 |
17 | FEJ | 0.8911 |
18 | 6JJ | 0.8905 |
19 | HM5 | 0.8868 |
20 | 7CU | 0.8826 |
21 | 855 | 0.8812 |
22 | 96X | 0.8807 |
23 | 66P | 0.8804 |
24 | L7N | 0.8803 |
25 | KET | 0.8792 |
26 | HCP | 0.8786 |
27 | 8HH | 0.8721 |
28 | EAR | 0.8720 |
29 | ASP PLP | 0.8717 |
30 | SC9 | 0.8695 |
31 | VKE | 0.8688 |
32 | AO6 | 0.8675 |
33 | 6DF | 0.8665 |
34 | KB8 | 0.8664 |
35 | LF5 | 0.8655 |
36 | LEU PLP | 0.8637 |
37 | SCW | 0.8632 |
38 | UI2 | 0.8630 |
39 | 5F3 | 0.8627 |
40 | G16 | 0.8621 |
41 | BPG | 0.8613 |
42 | 3QP | 0.8595 |
43 | 9KQ | 0.8587 |
44 | EXT | 0.8586 |
45 | 2T4 | 0.8572 |
46 | 6SC | 0.8565 |
47 | HTJ | 0.8559 |
48 | PLP 0A0 | 0.8554 |
49 | MZC | 0.8550 |
50 | IA7 | 0.8540 |
This union binding pocket(no: 2) in the query (biounit: 6c2z.bio1) has 24 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |