Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01324925
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 |
TNL![]() | 2,4,6-TRINITROTOLUENE | A | 1GVR | 0.76 | ![]() |
NIT![]() | 4-NITROANILINE | C,D | 1RMH | 0.76 | ![]() |
NIT![]() | 4-NITROANILINE | A,B,D,F,G,H,I | 2IXP | 0.76 | ![]() |
NIT![]() | 4-NITROANILINE | B | 1VBS | 0.76 | ![]() |
NIT![]() | 4-NITROANILINE | C | 1V9T | 0.76 | ![]() |
NIT![]() | 4-NITROANILINE | C,D | 1VBT | 0.76 | ![]() |
NIT![]() | 4-NITROANILINE | B | 1LOP | 0.76 | ![]() |
NIT![]() | 4-NITROANILINE | C,D | 1ZKF | 0.76 | ![]() |
NIT![]() | 4-NITROANILINE | B | 1PIP | 0.76 | ![]() |
4NM![]() | 4-NITROPHENYL METHANETHIOL | A,B | 2VO4 | 0.7 | ![]() |
3NT![]() | 3-NITROTOLUENE | A,B | 2BMR | 0.75 | ![]() |
3NT![]() | 3-NITROTOLUENE | A,B | 2HMO | 0.75 | ![]() |
PNZ![]() | P-NITRO-BENZYLAMINE | A,D,H | 2HJ4 | 0.75 | ![]() |
PNZ![]() | P-NITRO-BENZYLAMINE | A,B | 2C70 | 0.75 | ![]() |
PHZ![]() | 1-PHENYLHYDRAZINE | A | 2E2T | 0.75 | ![]() |
PHZ![]() | 1-PHENYLHYDRAZINE | D,H | 2AGL | 0.75 | ![]() |
PND![]() | P-NITROPHENYLHYDRAZINE | A,G | 1JMZ | 0.83 | ![]() |
NIN![]() | DINITROPHENYLENE | A | 1RSM | 0.76 | ![]() |
NIN![]() | DINITROPHENYLENE | A | 1GVY | 0.76 | ![]() |
NIN![]() | DINITROPHENYLENE | A | 1GW1 | 0.76 | ![]() |
NBZ![]() | NITROBENZENE | A,B | 2BMQ | 0.73 | ![]() |
NBZ![]() | NITROBENZENE | A,B | 3BGU | 0.73 | ![]() |
NPB![]() | 3-NITROPHENYLBORONIC ACID | A,B | 1KDS | 0.71 | ![]() |