Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00044111
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 |
4MA![]() | 4-METHYLBENZOIC ACID | A,H | 2HRG | 0.8 | ![]() |
4CB![]() | 4-CARBOXYPHENYLBORONIC ACID | A,B | 1KDW | 0.82 | ![]() |
156![]() | 4-[3-OXO-3-(5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRO-NAPHTHALEN-2- YL)-PROPENYL]-BENZOIC ACID | A | 1FCZ | 0.72 | ![]() |
3HP![]() | 3-HYDROXYPHENYLACETATE | M,N,O,P,Q,R | 3PCE | 0.71 | ![]() |
3HB![]() | 3-HYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCB | 0.72 | ![]() |
3HB![]() | 3-HYDROXYBENZOIC ACID | A | 2DKH | 0.72 | ![]() |
791![]() | 2-PHENYLMALONIC ACID | A | 1O4P | 0.78 | ![]() |
AC0![]() | 1-PHENYLETHANONE | A | 1ZK1 | 0.72 | ![]() |
AC0![]() | 1-PHENYLETHANONE | A | 1ZK4 | 0.72 | ![]() |
4HP![]() | 4-HYDROXYPHENYLACETATE | A,B,C,D | 2JBT | 0.74 | ![]() |
4HP![]() | 4-HYDROXYPHENYLACETATE | A | 2YYJ | 0.74 | ![]() |
4HP![]() | 4-HYDROXYPHENYLACETATE | A | 2YYM | 0.74 | ![]() |
4HP![]() | 4-HYDROXYPHENYLACETATE | B | 1AI6 | 0.74 | ![]() |
4HP![]() | 4-HYDROXYPHENYLACETATE | M,N,O,P,Q,R | 3PCG | 0.74 | ![]() |
34Z![]() | 3,4-dichlorobenzoate | X | 2QVY | 0.71 | ![]() |
34Z![]() | 3,4-dichlorobenzoate | X | 2QW0 | 0.71 | ![]() |
3BZ![]() | 3-chlorobenzoate | X | 2QVZ | 0.75 | ![]() |
3BZ![]() | 3-chlorobenzoate | X | 2QVX | 0.75 | ![]() |
174![]() | 4-CHLORO-BENZOIC ACID | X | 3DLP | 0.75 | ![]() |
174![]() | 4-CHLORO-BENZOIC ACID | X | 1T5D | 0.75 | ![]() |
ANQ![]() | ACENAPHTHENEQUINONE | H,J | 1OAX | 0.7 | ![]() |
2CL![]() | (2,6-DICHLOROPHENYL)ACETIC ACID | A | 2IPW | 0.74 | ![]() |
2CL![]() | (2,6-DICHLOROPHENYL)ACETIC ACID | A | 2IS7 | 0.74 | ![]() |
256![]() | PHENYL(SULFO)ACETIC ACID | A | 1O4Q | 0.73 | ![]() |
4FC![]() | A | 1YSG | 0.77 | ![]() | |
5PV![]() | 5-PHENYLVALERIC ACID | A,B | 2AY9 | 0.79 | ![]() |
173![]() | BENZOYL-FORMIC ACID | A,B | 1SZE | 0.82 | ![]() |
26C![]() | A,B | 2F7I | 0.77 | ![]() | |
2HC![]() | (2E)-3-(2-HYDROXYPHENYL)ACRYLIC ACID | A,B | 1V5Z | 0.7 | ![]() |