Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00499754
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 |
23N![]() | (2R)-2-benzyl-3-nitropropanoic acid | A | 2RFH | 0.72 | ![]() |
AHC![]() | 4-AMINOHYDROCINNAMIC ACID | A,B | 2AY1 | 0.77 | ![]() |
EAB![]() | (3-{(E)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID | A,B | 2H3T | 0.74 | ![]() |
PPN![]() | PARA-NITROPHENYLALANINE | I | 1YTJ | 0.87 | ![]() |
GW9![]() | 2-chloro-5-nitro-N-phenylbenzamide | A,D | 3E00 | 0.72 | ![]() |
CBL![]() | CHLORAMBUCIL | A,B | 3CSJ | 0.7 | ![]() |
ZAB![]() | (3-{(Z)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID | A,B | 2H3S | 0.74 | ![]() |
ZAB![]() | (3-{(Z)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID | A,B,C,D | 2H4B | 0.74 | ![]() |
53N![]() | 3-[5-(3-nitrophenyl)thiophen-2- yl]propanoic acid | A | 3DN5 | 0.72 | ![]() |
AAH![]() | H | 1KEL | 0.71 | ![]() | |
AAH![]() | B,H | 1FL6 | 0.71 | ![]() | |
PRQ![]() | (3S)-3-amino-3-(2-nitrophenyl)propanoic acid | C,F,I,L | 2VE6 | 0.86 | ![]() |
AAN![]() | 2-(4-NITROPHENYL)ACETIC ACID | B | 1AJN | 0.79 | ![]() |
KY1![]() | 4-(2-AMINOPHENYL)-4-OXOBUTANOIC ACID | A,B,C,D | 2CH2 | 0.7 | ![]() |
FCL![]() | 3-CHLORO-L-PHENYLALANINE | E,F | 1OKW | 0.76 | ![]() |
DIF![]() | 2-[2,6-DICHLOROPHENYL)AMINO]BENZENEACETIC ACID | A,B | 3CFQ | 0.72 | ![]() |
DIF![]() | 2-[2,6-DICHLOROPHENYL)AMINO]BENZENEACETIC ACID | A | 1SV9 | 0.72 | ![]() |
DIF![]() | 2-[2,6-DICHLOROPHENYL)AMINO]BENZENEACETIC ACID | A | 1NR6 | 0.72 | ![]() |
DIF![]() | 2-[2,6-DICHLOROPHENYL)AMINO]BENZENEACETIC ACID | A | 3HWV | 0.72 | ![]() |
DIF![]() | 2-[2,6-DICHLOROPHENYL)AMINO]BENZENEACETIC ACID | B | 1DVX | 0.72 | ![]() |
DIF![]() | 2-[2,6-DICHLOROPHENYL)AMINO]BENZENEACETIC ACID | A | 2B6D | 0.72 | ![]() |
DIF![]() | 2-[2,6-DICHLOROPHENYL)AMINO]BENZENEACETIC ACID | A,B,C,D | 1PXX | 0.72 | ![]() |
DIF![]() | 2-[2,6-DICHLOROPHENYL)AMINO]BENZENEACETIC ACID | A | 2B17 | 0.72 | ![]() |
200![]() | 4-CHLORO-L-PHENYLALANINE | A,B | 2AKW | 0.76 | ![]() |
MNP![]() | 2-(3-NITROPHENYL)ACETIC ACID | B | 1AI5 | 0.78 | ![]() |
PNC![]() | PARA-NITROBENZYL GLUTARYL GLYCINIC ACID | L | 1YEF | 0.71 | ![]() |
KYN![]() | KYNURENINE | A,B,C,D | 2R2N | 0.73 | ![]() |
KYN![]() | KYNURENINE | A,B | 3E2Z | 0.73 | ![]() |
KYN![]() | KYNURENINE | A | 1XT7 | 0.73 | ![]() |
KYN![]() | KYNURENINE | A | 1T5M | 0.73 | ![]() |
KYN![]() | KYNURENINE | A | 1T5N | 0.73 | ![]() |
KYN![]() | KYNURENINE | A | 2VOV | 0.73 | ![]() |
KYN![]() | KYNURENINE | A | 2VOX | 0.73 | ![]() |
NIY![]() | META-NITRO-TYROSINE | A | 2ADP | 0.76 | ![]() |
NIY![]() | META-NITRO-TYROSINE | A | 3DIV | 0.76 | ![]() |
NIY![]() | META-NITRO-TYROSINE | A | 2H5U | 0.76 | ![]() |
NIY![]() | META-NITRO-TYROSINE | A | 1K4Q | 0.76 | ![]() |
NIY![]() | META-NITRO-TYROSINE | B,G,O,Y | 1SDA | 0.76 | ![]() |