Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00376346
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 |
BRX | BROMAMPHENICOL | A,B,C,D,E,F | 2JKL | 0.77 | |
NTD | 2-{HYDROXY[2-NITRO-4-(TRIFLUOROMETHYL)PHENYL]METHYLENE}CYCLOHEXANE- 1,3-DIONE | A,B | 1T47 | 0.7 | |
NAF | M-(N,N,N-TRIMETHYLAMMONIO)-2,2,2- TRIFLUORO-1,1-DIHYDROXYETHYLBENZENE | A | 1AMN | 0.77 | |
NAF | M-(N,N,N-TRIMETHYLAMMONIO)-2,2,2- TRIFLUORO-1,1-DIHYDROXYETHYLBENZENE | A,B | 2H9Y | 0.77 | |
PIR | 2-(4-AMINO-PHENYL)-5-HYDROXYMETHYL- PYRROLIDINE-3,4-DIOL | A,B,C,D | 2MAS | 0.72 | |
NCH | P-NITROPHENYL-PHOSPHOCHOLINE | L | 1DL7 | 0.73 | |
CFQ | 1-(2-nitrophenyl)-2,2,2-trifluoroethyl]- arsenocholine | A,B | 2V97 | 0.76 | |
CFQ | 1-(2-nitrophenyl)-2,2,2-trifluoroethyl]- arsenocholine | A,B | 2V98 | 0.76 | |
CFQ | 1-(2-nitrophenyl)-2,2,2-trifluoroethyl]- arsenocholine | A,B | 2V96 | 0.76 | |
TAA | [4-(2,2,2-TRIFLUORO-ACETYLAMINO)- BENZYL]-PHOSPHONIC ACID MONO-[2- (2,2-DICHLORO-1-HYDROXY-ETHYLAMINO)- 3-HYDROXY-1-(4-NITRO-PHENYL)-PROPYL] ESTER | A,B,C,D | 1CT8 | 0.71 | |
BPN | PARANITROBENZYL ALCOHOL | H,L | 1YEG | 0.78 | |
RPN | (R)-1-PARA-NITRO-PHENYL-2-AZIDO- ETHANOL | A,B,C,D | 1PX0 | 0.84 | |
RPN | (R)-1-PARA-NITRO-PHENYL-2-AZIDO- ETHANOL | A,B,C,D | 2ZHM | 0.84 | |
RPN | (R)-1-PARA-NITRO-PHENYL-2-AZIDO- ETHANOL | A | 2ZHN | 0.84 | |
CLC | N-ACETYL-P-NITROPHENYLSERINOL | A | 1GRR | 0.81 | |
RNO | (R)-PARA-NITROSTYRENE OXIDE | A,B,C,D | 1ZMT | 0.74 | |
SOA | ISATOIC ANHYDRIDE | A | 1BIO | 0.71 | |
DOF | (S)-2-(4-NITROBENZYL)-1,4,7,10- TETRAAZACYCLODODECANE-N,N',N'',N'''- TETRAACETATE | A,B,C,D | 1NC4 | 0.72 | |
A48 | 4-[(DIMESITYLBORYL)(2,2,2-TRIFLUOROETHYL)AMINO]PHENOL | A,B | 2Q6J | 0.71 | |
GN8 | (Z)-3-BENZYL-5-(2-HYDROXY-3-NITROBENZYLIDENE)- 2-THIOXOTHIAZOLIDIN-4-ONE | A,B,C,D,E,F | 2P6F | 0.72 | |
SNO | (S)-PARA-NITROSTYRENE OXIDE | A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P | 1ZO8 | 0.74 | |
LI6 | 3,4-DIHYDROXY-1-METHYLQUINOLIN- 2(1H)-ONE | A | 1YXV | 0.71 | |
DNT | 2-[1-METHYLHEXYL]-4,6-DINITROPHENOL | A,B,C | 1NEN | 0.73 | |
BRS | 2-[1-(4-CHLORO-PHENYL)-ETHYL]-4,6- DINITRO-PHENOL | A,B,D,M,N,O,P | 1KFY | 0.7 | |
TNS | A,B,L | 2G2R | 0.75 | ||
HNT | [(3R)-7-NITRO-1,2,3,4-TETRAHYDROISOQUINOLIN- 3-YL]METHANOL | A,B | 2G70 | 0.77 | |
CLM | CHLORAMPHENICOL | A | 1K01 | 0.76 | |
CLM | CHLORAMPHENICOL | 1,2,4,A,B,C, D,E,J,K,L,M, N,O,P,R,S,T, U,V,Z | 1NJI | 0.76 | |
CLM | CHLORAMPHENICOL | A,B,C,D,E,F | 2JKL | 0.76 | |
CLM | CHLORAMPHENICOL | A | 2XAT | 0.76 | |
CLM | CHLORAMPHENICOL | A | 4CLA | 0.76 | |
CLM | CHLORAMPHENICOL | A | 1CLA | 0.76 | |
CLM | CHLORAMPHENICOL | A,B,C,D,E,F | 1USQ | 0.76 | |
CLM | CHLORAMPHENICOL | A,B,C,D,E,F | 2JKJ | 0.76 | |
CLM | CHLORAMPHENICOL | A,B | 2UXP | 0.76 | |
CLM | CHLORAMPHENICOL | A | 1QHS | 0.76 | |
CLM | CHLORAMPHENICOL | A | 1QHY | 0.76 | |
CLM | CHLORAMPHENICOL | A | 3CLA | 0.76 | |
NCR | 2-NITRO-P-CRESOL | A,B | 1AHV | 0.73 | |
CL8 | CHLORAMPHENICOL SUCCINATE | A,B,C,D,E,F | 2JKN | 0.71 | |
CLK | ALPHA-N-DICHLOROACETYL-P-AMINOPHENYLSERINOL | A | 1GRQ | 0.71 |