Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02091473
You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.
You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.
Ligand | Ligand name | Chain | PDB | Tanimoto | Ligand in PDB |
---|---|---|---|---|---|
Ligand | Ligand name | Chain | PDB | Tanimoto | Ligand in PDB |
JUG | 5-hydroxynaphthalene-1,4-dione | A,B,C,D,E,F | 3B7J | 0.71 | |
PCQ | 3,5,3',5'-TETRACHLORO-BIPHENYL- 4,4'-DIOL | A,B | 1G3M | 0.74 | |
PCQ | 3,5,3',5'-TETRACHLORO-BIPHENYL- 4,4'-DIOL | A,B | 2G5U | 0.74 | |
1FL | 5-(2,4-DIFLUOROPHENYL)-2-HYDROXY- BENZOIC ACID | A,B | 2BXE | 0.7 | |
1FL | 5-(2,4-DIFLUOROPHENYL)-2-HYDROXY- BENZOIC ACID | A,B | 3D2T | 0.7 | |
NE2 | 3,3',4',5-TETRACHLOROBIPHENYL-4- OL | A,B | 2GAB | 0.72 | |
NE1 | 2',3,3',4',5-PENTACHLOROBIPHENYL- 4-OL | A,B | 2G9K | 0.71 | |
SAL | 2-HYDROXYBENZOIC ACID | A | 2I2Z | 0.7 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B,C | 1FIQ | 0.7 | |
SAL | 2-HYDROXYBENZOIC ACID | A | 2I30 | 0.7 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 1PTH | 0.7 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 3DEU | 0.7 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B,C,D | 2E1Q | 0.7 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 3HGX | 0.7 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 3BPX | 0.7 | |
SAL | 2-HYDROXYBENZOIC ACID | A | 1WYG | 0.7 | |
SAL | 2-HYDROXYBENZOIC ACID | A | 1JGS | 0.7 | |
SAL | 2-HYDROXYBENZOIC ACID | X | 1M6E | 0.7 | |
SAL | 2-HYDROXYBENZOIC ACID | A | 3B9M | 0.7 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 1FO4 | 0.7 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 1Y7I | 0.7 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 2FN1 | 0.7 | |
CHB | 3-CHLORO-4-HYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCH | 0.76 | |
C2U | 3,5-dichloro-2-hydroxybenzoic acid | A | 3C3U | 0.82 | |
C2U | 3,5-dichloro-2-hydroxybenzoic acid | A | 3CV7 | 0.82 | |
3BZ | 3-chlorobenzoate | X | 2QVZ | 0.71 | |
3BZ | 3-chlorobenzoate | X | 2QVX | 0.71 | |
3CA | A,B | 2B77 | 0.79 | ||
3C4 | (3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID | A,B,C,D | 3E5U | 0.76 | |
3C4 | (3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID | A,B | 3E6B | 0.76 | |
3C4 | (3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID | A,B,C,D | 3E5X | 0.76 | |
3C4 | (3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID | A,B | 2H6B | 0.76 | |
3C4 | (3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID | C | 3E6C | 0.76 | |
HCC | 2',4,4'-TRIHYDROXYCHALCONE | D | 1FP1 | 0.72 | |
AFI | 2-[4-(4-CHLOROPHENYL)CYCLOHEXYLIDENE]- 3,4-DIHYDROXY-1(2H)-NAPHTHALENONE | A,B | 1UUM | 0.72 | |
DBE | bis(4-hydroxyphenyl)methanone | A | 2VKU | 0.73 | |
789 | 3-BROMO-6-HYDROXY-2-(4-HYDROXYPHENYL)- 1H-INDEN-1-ONE | A,B | 1ZAF | 0.74 | |
G50 | 3-(4-HYDROXYPHENYL)-1-(2,4,6-TRIHYDROXYPHENYL)PROPAN- 1-ONE | A,B | 2UXI | 0.72 |