Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02302728
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 |
AAN![]() | 2-(4-NITROPHENYL)ACETIC ACID | B | 1AJN | 0.82 | ![]() |
MNP![]() | 2-(3-NITROPHENYL)ACETIC ACID | B | 1AI5 | 0.79 | ![]() |
2UN![]() | {4-[2-BENZYL-3-METHOXY-2-(METHOXYCARBONYL)- 3-OXOPROPYL]PHENYL}SULFAMIC ACID | A,B | 2H02 | 0.78 | ![]() |
PPN![]() | PARA-NITROPHENYLALANINE | I | 1YTJ | 0.78 | ![]() |
PRQ![]() | (3S)-3-amino-3-(2-nitrophenyl)propanoic acid | C,F,I,L | 2VE6 | 0.76 | ![]() |
AHC![]() | 4-AMINOHYDROCINNAMIC ACID | A,B | 2AY1 | 0.75 | ![]() |
53N![]() | 3-[5-(3-nitrophenyl)thiophen-2- yl]propanoic acid | A | 3DN5 | 0.74 | ![]() |
CFQ![]() | 1-(2-nitrophenyl)-2,2,2-trifluoroethyl]- arsenocholine | A,B | 2V97 | 0.73 | ![]() |
CFQ![]() | 1-(2-nitrophenyl)-2,2,2-trifluoroethyl]- arsenocholine | A,B | 2V98 | 0.73 | ![]() |
CFQ![]() | 1-(2-nitrophenyl)-2,2,2-trifluoroethyl]- arsenocholine | A,B | 2V96 | 0.73 | ![]() |
23N![]() | (2R)-2-benzyl-3-nitropropanoic acid | A | 2RFH | 0.72 | ![]() |
4NB![]() | 4-NITROBENZOIC ACID | A,B | 3CHT | 0.72 | ![]() |
TNS![]() | A,B,L | 2G2R | 0.71 | ![]() | |
3UN![]() | (4-{4-[(TERT-BUTOXYCARBONYL)AMINO]- 2,2-BIS(ETHOXYCARBONYL)BUTYL}PHENYL)SULFAMIC ACID | A | 2H03 | 0.7 | ![]() |
3NT![]() | 3-NITROTOLUENE | A,B | 2BMR | 0.7 | ![]() |
3NT![]() | 3-NITROTOLUENE | A,B | 2HMO | 0.7 | ![]() |
AAH![]() | H | 1KEL | 0.7 | ![]() | |
AAH![]() | B,H | 1FL6 | 0.7 | ![]() |