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No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 1 families. | |||||
1 | 5NUC | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
2 | 1A3U | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
3 | 4WOR | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
4 | 1STH | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
5 | 1ENC | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
6 | 3NQT | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
7 | 1STA | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
8 | 3PMF | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
9 | 6OK8 | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
10 | 1STY | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
11 | 3MEH | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
12 | 1STB | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
13 | 1TR5 | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
14 | 1A2U | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
15 | 3R3O | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
16 | 3BDC | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
17 | 1NUC | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
18 | 3MXP | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
19 | 1A2T | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
20 | 1SYB | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
21 | 2NUC | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
22 | 3MVV | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
23 | 3OSO | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
24 | 3MZ5 | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
25 | 1A3T | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
26 | 2SNM | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
27 | 3MHB | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
28 | 1SYF | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
29 | 3D8G | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
30 | 2ENB | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
31 | 1SNC | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
32 | 1TT2 | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
33 | 3NUC | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
34 | 3NXW | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
35 | 1SNM | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
36 | 1STG | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
37 | 1AEX | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
38 | 3NP8 | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
39 | 3D6C | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
40 | 2OXP | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
41 | 3DHQ | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
42 | 1SYD | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
43 | 3NK9 | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
44 | 1A3V | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 1 families. | |||||
1 | 5NUC | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
2 | 1A3U | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
3 | 4WOR | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
4 | 1STH | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
5 | 1ENC | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
6 | 3NQT | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
7 | 1STA | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
8 | 3PMF | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
9 | 6OK8 | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
10 | 1STY | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
11 | 3MEH | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
12 | 1STB | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
13 | 1TR5 | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
14 | 1A2U | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
15 | 3R3O | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
16 | 3BDC | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
17 | 1NUC | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
18 | 3MXP | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
19 | 1A2T | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
20 | 1SYB | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
21 | 2NUC | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
22 | 3MVV | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
23 | 3OSO | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
24 | 3MZ5 | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
25 | 1A3T | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
26 | 2SNM | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
27 | 3MHB | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
28 | 1SYF | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
29 | 3D8G | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
30 | 2ENB | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
31 | 1SNC | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
32 | 1TT2 | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
33 | 3NUC | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
34 | 3NXW | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
35 | 1SNM | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
36 | 1STG | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
37 | 1AEX | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
38 | 3NP8 | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
39 | 3D6C | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
40 | 2OXP | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
41 | 3DHQ | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
42 | 1SYD | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
43 | 3NK9 | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
44 | 1A3V | - | THP | C10 H16 N2 O11 P2 | CC1=CN(C(=.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | THP | 1 | 1 |
2 | T3P | 0.753846 | 0.971014 |
3 | TMP | 0.661972 | 0.985507 |
4 | NYM | 0.652778 | 0.957747 |
5 | FDM | 0.652778 | 0.944444 |
6 | ATM | 0.602564 | 0.918919 |
7 | ATY | 0.592593 | 0.944444 |
8 | TYD | 0.556962 | 0.971429 |
9 | 2DT | 0.540541 | 0.985507 |
10 | TTP | 0.53012 | 0.971429 |
11 | THM | 0.528571 | 0.84507 |
12 | LLT | 0.528571 | 0.84507 |
13 | 3DR DT DT DT DT DT | 0.525773 | 0.90411 |
14 | TBD | 0.506024 | 0.931507 |
15 | AZD | 0.505747 | 0.906667 |
16 | TPE | 0.5 | 0.893333 |
17 | PAX | 0.5 | 0.85 |
18 | 0DN | 0.493151 | 0.830986 |
19 | TTP MG | 0.488372 | 0.942857 |
20 | 18T | 0.473684 | 0.905405 |
21 | TRH | 0.473684 | 0.905405 |
22 | 1JB | 0.473684 | 0.905405 |
23 | ABT | 0.473118 | 0.883117 |
24 | 9RC | 0.473118 | 0.82716 |
25 | DT ME6 DT | 0.471698 | 0.868421 |
26 | DAU | 0.46875 | 0.905405 |
27 | AZZ | 0.468354 | 0.8 |
28 | T3Q | 0.463918 | 0.881579 |
29 | T3F | 0.463918 | 0.881579 |
30 | UFP | 0.4625 | 0.90411 |
31 | TLO | 0.462366 | 0.917808 |
32 | 0N2 | 0.459184 | 0.87013 |
33 | 3R2 | 0.458333 | 0.893333 |
34 | TDX | 0.458333 | 0.917808 |
35 | 5HU | 0.45679 | 0.943662 |
36 | BRU | 0.45679 | 0.90411 |
37 | ADS THS THS THS | 0.45614 | 0.755814 |
38 | MMF | 0.454545 | 0.881579 |
39 | 5IU | 0.451219 | 0.90411 |
40 | D4M | 0.45 | 0.941176 |
41 | DWN | 0.44898 | 0.881579 |
42 | 3YN | 0.44898 | 0.905405 |
43 | QDM | 0.445545 | 0.87013 |
44 | T46 | 0.444444 | 0.905405 |
45 | TXS | 0.444444 | 0.786667 |
46 | FNF | 0.441176 | 0.893333 |
47 | 1YF | 0.441176 | 0.893333 |
48 | AKM | 0.441176 | 0.860759 |
49 | 0FX | 0.44 | 0.881579 |
50 | D3T | 0.436782 | 0.971429 |
51 | T3S | 0.433735 | 0.786667 |
52 | UM3 | 0.43038 | 0.927536 |
53 | JHZ | 0.427184 | 0.858974 |
54 | 4TG | 0.423077 | 0.893333 |
55 | BVP | 0.420455 | 0.943662 |
56 | FUH | 0.409091 | 0.881579 |
57 | QUH | 0.409091 | 0.881579 |
This union binding pocket(no: 1) in the query (biounit: 3meh.bio1) has 18 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |