Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03322584
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 |
NPC![]() | 4-HYDROXY-3-NITROPHENYLACETYL-EPSILON- AMINOCAPROIC ACID ANION | H,I,J | 1A6V | 0.73 | ![]() |
RNO![]() | (R)-PARA-NITROSTYRENE OXIDE | A,B,C,D | 1ZMT | 0.7 | ![]() |
NPO![]() | P-NITROPHENOL | A,B | 1Z44 | 0.73 | ![]() |
NPO![]() | P-NITROPHENOL | X | 2ZYW | 0.73 | ![]() |
NPO![]() | P-NITROPHENOL | H,L | 1YEK | 0.73 | ![]() |
NPO![]() | P-NITROPHENOL | A,C,E,G | 43CA | 0.73 | ![]() |
NPO![]() | P-NITROPHENOL | A | 1LS6 | 0.73 | ![]() |
NPO![]() | P-NITROPHENOL | X | 2ZVP | 0.73 | ![]() |
NPO![]() | P-NITROPHENOL | A,B | 2I10 | 0.73 | ![]() |
NPO![]() | P-NITROPHENOL | A | 1VAH | 0.73 | ![]() |
NPO![]() | P-NITROPHENOL | A,B | 3ETT | 0.73 | ![]() |
NPO![]() | P-NITROPHENOL | A,B | 2D20 | 0.73 | ![]() |
NPO![]() | P-NITROPHENOL | X | 2ZYV | 0.73 | ![]() |
TYQ![]() | 3-AMINO-6-HYDROXY-TYROSINE | A,B | 1D6Y | 0.7 | ![]() |
TYQ![]() | 3-AMINO-6-HYDROXY-TYROSINE | A,B | 1D6U | 0.7 | ![]() |
BPN![]() | PARANITROBENZYL ALCOHOL | H,L | 1YEG | 0.7 | ![]() |
CFQ![]() | 1-(2-nitrophenyl)-2,2,2-trifluoroethyl]- arsenocholine | A,B | 2V97 | 0.71 | ![]() |
CFQ![]() | 1-(2-nitrophenyl)-2,2,2-trifluoroethyl]- arsenocholine | A,B | 2V98 | 0.71 | ![]() |
CFQ![]() | 1-(2-nitrophenyl)-2,2,2-trifluoroethyl]- arsenocholine | A,B | 2V96 | 0.71 | ![]() |
TY2![]() | 3-AMINO-L-TYROSINE | A,B | 2VH3 | 0.72 | ![]() |
DNT![]() | 2-[1-METHYLHEXYL]-4,6-DINITROPHENOL | A,B,C | 1NEN | 0.8 | ![]() |
DNC![]() | 3,5-DINITROCATECHOL | A | 3BWY | 0.71 | ![]() |
DNC![]() | 3,5-DINITROCATECHOL | A | 3BWM | 0.71 | ![]() |
DNC![]() | 3,5-DINITROCATECHOL | A | 1VID | 0.71 | ![]() |
NPF![]() | ORTHONITROPHENYL-BETA-D-FUCOPYRANOSIDE | A,B,C | 1EFA | 0.71 | ![]() |
NPF![]() | ORTHONITROPHENYL-BETA-D-FUCOPYRANOSIDE | A,B | 2PAF | 0.71 | ![]() |
NPF![]() | ORTHONITROPHENYL-BETA-D-FUCOPYRANOSIDE | A,B,C | 1JWL | 0.71 | ![]() |
AZY![]() | 3-AZIDO-L-TYROSINE | A | 2YXN | 0.71 | ![]() |
DNF![]() | 2,4-DINITROPHENOL | A,B | 2B16 | 0.76 | ![]() |
DNF![]() | 2,4-DINITROPHENOL | H,J,L,N | 1OAU | 0.76 | ![]() |
DNF![]() | 2,4-DINITROPHENOL | A | 1GVO | 0.76 | ![]() |
DNF![]() | 2,4-DINITROPHENOL | A,B | 2B15 | 0.76 | ![]() |
DNF![]() | 2,4-DINITROPHENOL | A,B | 2B14 | 0.76 | ![]() |
BRS![]() | 2-[1-(4-CHLORO-PHENYL)-ETHYL]-4,6- DINITRO-PHENOL | A,B,D,M,N,O,P | 1KFY | 0.75 | ![]() |
NPA![]() | 2-(4-HYDROXY-3-NITROPHENYL)ACETIC ACID | H | 1NGP | 0.76 | ![]() |
TNF![]() | PICRIC ACID | A | 1GVS | 0.74 | ![]() |
TNF![]() | PICRIC ACID | X | 1VYP | 0.74 | ![]() |
TNF![]() | PICRIC ACID | A | 1VYR | 0.74 | ![]() |
TNF![]() | PICRIC ACID | X | 1VYS | 0.74 | ![]() |
RPN![]() | (R)-1-PARA-NITRO-PHENYL-2-AZIDO- ETHANOL | A,B,C,D | 1PX0 | 0.71 | ![]() |
RPN![]() | (R)-1-PARA-NITRO-PHENYL-2-AZIDO- ETHANOL | A,B,C,D | 2ZHM | 0.71 | ![]() |
RPN![]() | (R)-1-PARA-NITRO-PHENYL-2-AZIDO- ETHANOL | A | 2ZHN | 0.71 | ![]() |
SNO![]() | (S)-PARA-NITROSTYRENE OXIDE | A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P | 1ZO8 | 0.7 | ![]() |
NCR![]() | 2-NITRO-P-CRESOL | A,B | 1AHV | 0.84 | ![]() |
2AC![]() | 2-AMINO-P-CRESOL | H,I | 1A2C | 0.78 | ![]() |
2AC![]() | 2-AMINO-P-CRESOL | A | 1L4M | 0.78 | ![]() |
NIY![]() | META-NITRO-TYROSINE | A | 2ADP | 0.79 | ![]() |
NIY![]() | META-NITRO-TYROSINE | A | 3DIV | 0.79 | ![]() |
NIY![]() | META-NITRO-TYROSINE | A | 2H5U | 0.79 | ![]() |
NIY![]() | META-NITRO-TYROSINE | A | 1K4Q | 0.79 | ![]() |
NIY![]() | META-NITRO-TYROSINE | B,G,O,Y | 1SDA | 0.79 | ![]() |
ANX![]() | 2,5-DINITROPHENOL | A,B,C,D,E,F, G,H | 2BFG | 0.75 | ![]() |
EPN![]() | 3-(4-NITRO-PHENOXY)-PROPAN-1-OL | A | 2SAM | 0.72 | ![]() |