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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 | 1P5B | - | FMN | C17 H21 N4 O9 P | Cc1cc2c(cc.... |
2 | 2A7N | - | FMN | C17 H21 N4 O9 P | Cc1cc2c(cc.... |
3 | 1HUV | - | FMN | C17 H21 N4 O9 P | Cc1cc2c(cc.... |
4 | 2A85 | - | HOC | C8 H16 O3 | CCCCCC[C@@.... |
5 | 3GIY | - | FMN | C17 H21 N4 O9 P | Cc1cc2c(cc.... |
6 | 1P4C | - | FMN | C17 H21 N4 O9 P | Cc1cc2c(cc.... |
7 | 2A7P | - | FMN | C17 H21 N4 O9 P | Cc1cc2c(cc.... |
8 | 6BFG | - | FMN | C17 H21 N4 O9 P | Cc1cc2c(cc.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 1 families. | |||||
1 | 6R9V | - | FMN | C17 H21 N4 O9 P | Cc1cc2c(cc.... |
2 | 6RHT | - | FMN | C17 H21 N4 O9 P | Cc1cc2c(cc.... |
3 | 6A0V | - | FMN | C17 H21 N4 O9 P | Cc1cc2c(cc.... |
4 | 5ZZX | - | FMN | C17 H21 N4 O9 P | Cc1cc2c(cc.... |
5 | 6A19 | - | FMN | C17 H21 N4 O9 P | Cc1cc2c(cc.... |
6 | 6A1A | - | FMN | C17 H21 N4 O9 P | Cc1cc2c(cc.... |
7 | 6A1H | - | 9O9 | C18 H22 N3 O9 P | Cc1cc2c(cc.... |
8 | 5ZZZ | - | FMN | C17 H21 N4 O9 P | Cc1cc2c(cc.... |
9 | 5ZZS | - | BEZ | C7 H6 O2 | c1ccc(cc1).... |
10 | 6A0M | - | FMN | C17 H21 N4 O9 P | Cc1cc2c(cc.... |
11 | 6A21 | - | 9OR | C20 H25 N4 O12 P | Cc1cc2c(cc.... |
12 | 6A0G | - | FMN | C17 H21 N4 O9 P | Cc1cc2c(cc.... |
13 | 6A1M | - | 9O9 | C18 H22 N3 O9 P | Cc1cc2c(cc.... |
14 | 6A0O | - | FMN | C17 H21 N4 O9 P | Cc1cc2c(cc.... |
15 | 6A1R | - | 9OC | C25 H29 N4 O10 P | Cc1cc2c(cc.... |
16 | 6A13 | - | FMN | C17 H21 N4 O9 P | Cc1cc2c(cc.... |
17 | 5ZZP | - | FMN | C17 H21 N4 O9 P | Cc1cc2c(cc.... |
18 | 6A0Y | - | FMN | C17 H21 N4 O9 P | Cc1cc2c(cc.... |
19 | 6A23 | - | 173 | C8 H6 O3 | c1ccc(cc1).... |
20 | 5ZZR | - | FMN | C17 H21 N4 O9 P | Cc1cc2c(cc.... |
21 | 6A0D | - | FMN | C17 H21 N4 O9 P | Cc1cc2c(cc.... |
22 | 6A1L | - | BEZ | C7 H6 O2 | c1ccc(cc1).... |
23 | 6A08 | - | FMN | C17 H21 N4 O9 P | Cc1cc2c(cc.... |
24 | 5ZZY | - | 2OP | C3 H6 O3 | C[C@@H](C(.... |
25 | 5ZZQ | - | FMN | C17 H21 N4 O9 P | Cc1cc2c(cc.... |
26 | 6A1P | - | 9O9 | C18 H22 N3 O9 P | Cc1cc2c(cc.... |
27 | 6A11 | - | FMN | C17 H21 N4 O9 P | Cc1cc2c(cc.... |
28 | 6A00 | - | FMN | C17 H21 N4 O9 P | Cc1cc2c(cc.... |
29 | 1AL8 | Ki = 4.8 uM | DHP | C14 H23 N O3 | CCCCCCCCCC.... |
30 | 1GOX | - | FMN | C17 H21 N4 O9 P | Cc1cc2c(cc.... |
31 | 3SGZ | - | HO6 | C10 H8 N2 O2 S2 | Cc1ccc(cc1.... |
32 | 1TB3 | - | FMN | C17 H21 N4 O9 P | Cc1cc2c(cc.... |
33 | 1P5B | - | FMN | C17 H21 N4 O9 P | Cc1cc2c(cc.... |
34 | 2A7N | - | FMN | C17 H21 N4 O9 P | Cc1cc2c(cc.... |
35 | 1HUV | - | FMN | C17 H21 N4 O9 P | Cc1cc2c(cc.... |
36 | 2A85 | - | HOC | C8 H16 O3 | CCCCCC[C@@.... |
37 | 3GIY | - | FMN | C17 H21 N4 O9 P | Cc1cc2c(cc.... |
38 | 1P4C | - | FMN | C17 H21 N4 O9 P | Cc1cc2c(cc.... |
39 | 2A7P | - | FMN | C17 H21 N4 O9 P | Cc1cc2c(cc.... |
40 | 1KBI | - | PYR | C3 H4 O3 | CC(=O)C(=O.... |
41 | 1FCB | - | PYR | C3 H4 O3 | CC(=O)C(=O.... |
42 | 6DVI | - | FMN | C17 H21 N4 O9 P | Cc1cc2c(cc.... |
43 | 6DVH | - | FMN | C17 H21 N4 O9 P | Cc1cc2c(cc.... |
44 | 6BFG | - | FMN | C17 H21 N4 O9 P | Cc1cc2c(cc.... |
45 | 2RDW | - | FMN | C17 H21 N4 O9 P | Cc1cc2c(cc.... |
46 | 2RDT | Ki ~ 15 nM | 2RD | C15 H27 N3 O2 S | CCCCCCCCCC.... |
47 | 2RDU | - | GLV | C2 H2 O3 | C(=O)C(=O).... |
48 | 2J6X | - | FMN | C17 H21 N4 O9 P | Cc1cc2c(cc.... |
49 | 4YL2 | - | PYR | C3 H4 O3 | CC(=O)C(=O.... |
50 | 2DU2 | - | FMN | C17 H21 N4 O9 P | Cc1cc2c(cc.... |
51 | 2E77 | - | PYR | C3 H4 O3 | CC(=O)C(=O.... |
52 | 2ZFA | - | FMN | C17 H21 N4 O9 P | Cc1cc2c(cc.... |
53 | 4RJE | - | FNR | C17 H23 N4 O9 P | Cc1cc2c(cc.... |
54 | 2NLI | - | LAC | C3 H6 O3 | C[C@H](C(=.... |
55 | 1KBJ | - | FMN | C17 H21 N4 O9 P | Cc1cc2c(cc.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | FMN | 1 | 1 |
2 | RBF | 0.75641 | 0.876712 |
3 | 9O9 | 0.574468 | 0.934211 |
4 | RS3 | 0.571429 | 0.831169 |
5 | FAD | 0.543307 | 0.876543 |
6 | FAS | 0.543307 | 0.876543 |
7 | FAE | 0.539062 | 0.865854 |
8 | UBG | 0.534351 | 0.888889 |
9 | 5DD | 0.475248 | 0.972603 |
10 | LFN | 0.475 | 0.643836 |
11 | C3F | 0.473684 | 0.74359 |
12 | CF4 | 0.463918 | 0.734177 |
13 | FAY | 0.446043 | 0.864198 |
14 | FNR | 0.444444 | 0.909091 |
15 | RFL | 0.442857 | 0.845238 |
16 | 4LS | 0.411215 | 0.875 |
17 | 1VY | 0.406593 | 0.769231 |
18 | DLZ | 0.404494 | 0.782051 |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | MLZ | 1.0000 |
2 | EXY | 0.9637 |
3 | MLY | 0.9569 |
4 | LYS | 0.9553 |
5 | 3H2 | 0.9520 |
6 | ARG | 0.9487 |
7 | SLZ | 0.9432 |
8 | OOG | 0.9407 |
9 | NPI | 0.9403 |
10 | UN1 | 0.9361 |
11 | PBN | 0.9354 |
12 | GGB | 0.9296 |
13 | CUW | 0.9289 |
14 | NNH | 0.9284 |
15 | 7XA | 0.9268 |
16 | AG2 | 0.9256 |
17 | GRQ | 0.9195 |
18 | DAR | 0.9146 |
19 | DIR | 0.9115 |
20 | NWH | 0.9069 |
21 | DHH | 0.9060 |
22 | 3GZ | 0.9056 |
23 | 5XA | 0.9047 |
24 | 8SZ | 0.9038 |
25 | NMH | 0.9030 |
26 | OYA | 0.9023 |
27 | 7C3 | 0.9012 |
28 | AHN | 0.8956 |
29 | FXY | 0.8935 |
30 | DLY | 0.8925 |
31 | IAR | 0.8902 |
32 | 9YT | 0.8895 |
33 | UNA | 0.8890 |
34 | 1N5 | 0.8829 |
35 | DDK | 0.8814 |
36 | 11C | 0.8810 |
37 | M1T | 0.8772 |
38 | X1R | 0.8727 |
39 | BHH | 0.8718 |
40 | HIC | 0.8650 |
This union binding pocket(no: 1) in the query (biounit: 1p4c.bio1) has 33 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 1p4c.bio1) has 33 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 3) in the query (biounit: 1p4c.bio1) has 33 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 4) in the query (biounit: 1p4c.bio1) has 33 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |