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- Structure Biounit | Ligand Information
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- Class : .ZIP | .CSV
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 266 families. | |||||
1 | 4LUZ | Kd = 20 uM | 1XT | C29 H22 N2 O6 | Cc1cccc(c1.... |
2 | 4LW1 | Kd = 710 uM | 1XS | C11 H6 Cl F O3 | c1cc(c(cc1.... |
3 | 4LWC | - | 1XU | C28 H18 Cl3 N3 O3 S | c1cc(ccc1C.... |
4 | 4LUV | Kd = 1400 uM | 1XS | C11 H6 Cl F O3 | c1cc(c(cc1.... |
5 | 4LUO | Kd = 580 uM | 1DZ | C17 H14 N2 O2 | Cc1cccc(c1.... |
6 | 4IPH | Kd = 5.01 uM | 1FJ | C17 H13 N3 O2 S3 | Cc1cccc(c1.... |
7 | 4IJH | Kd = 47 uM | 1EJ | C17 H9 Cl F N3 O2 S2 | c1cc(ccc1c.... |
8 | 5E7N | Kd = 30 uM | 5KR | C21 H17 Br N2 O5 S | Cc1ccc(cc1.... |
9 | 4IJL | Kd = 135 uM | 1EK | C18 H12 Cl N3 O2 S2 | c1ccc(cc1).... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 220 families. | |||||
1 | 4LUZ | Kd = 20 uM | 1XT | C29 H22 N2 O6 | Cc1cccc(c1.... |
2 | 4LW1 | Kd = 710 uM | 1XS | C11 H6 Cl F O3 | c1cc(c(cc1.... |
3 | 4LWC | - | 1XU | C28 H18 Cl3 N3 O3 S | c1cc(ccc1C.... |
4 | 4LUV | Kd = 1400 uM | 1XS | C11 H6 Cl F O3 | c1cc(c(cc1.... |
5 | 4LUO | Kd = 580 uM | 1DZ | C17 H14 N2 O2 | Cc1cccc(c1.... |
6 | 4IPH | Kd = 5.01 uM | 1FJ | C17 H13 N3 O2 S3 | Cc1cccc(c1.... |
7 | 4IJH | Kd = 47 uM | 1EJ | C17 H9 Cl F N3 O2 S2 | c1cc(ccc1c.... |
8 | 5E7N | Kd = 30 uM | 5KR | C21 H17 Br N2 O5 S | Cc1ccc(cc1.... |
9 | 4IJL | Kd = 135 uM | 1EK | C18 H12 Cl N3 O2 S2 | c1ccc(cc1).... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | 1FJ | 1 | 1 |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | FO2 | 0.9031 |
2 | KT4 | 0.8921 |
3 | FXE | 0.8856 |
4 | 36K | 0.8844 |
5 | Q7U | 0.8840 |
6 | 609 | 0.8803 |
7 | KSY | 0.8797 |
8 | MYU | 0.8787 |
9 | KT1 | 0.8786 |
10 | QUE | 0.8752 |
11 | VXS | 0.8742 |
12 | TNC | 0.8718 |
13 | 8QH | 0.8716 |
14 | T5J | 0.8714 |
15 | 8V7 | 0.8695 |
16 | KTG | 0.8692 |
17 | 5Z5 | 0.8690 |
18 | CK8 | 0.8681 |
19 | MYC | 0.8646 |
20 | QUG | 0.8645 |
21 | E3U | 0.8643 |
22 | 7FC | 0.8631 |
23 | 3G5 | 0.8596 |
24 | BER | 0.8580 |
25 | 338 | 0.8575 |
26 | LU2 | 0.8568 |
27 | DTQ | 0.8563 |
28 | BIT | 0.8557 |
29 | 6JM | 0.8548 |
30 | NGV | 0.8542 |
31 | M62 | 0.8528 |
This union binding pocket(no: 1) in the query (biounit: 4iph.bio1) has 26 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 4iph.bio1) has 26 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |