Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00733410
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 |
B66 | 4-{[(1R,2S)-1,2-dihydroxy-2-methyl- 3-(4-nitrophenoxy)propyl]amino}- 2-(trifluoromethyl)benzonitrile | A | 3B66 | 0.74 |  |
145 | 1-O-[O-NITROPHENYL]-BETA-D-GALACTOPYRANOSE | A,B,C | 2PE5 | 0.73 | |
| 145 | 1-O-[O-NITROPHENYL]-BETA-D-GALACTOPYRANOSE | A,B,C,D | 1JYV | 0.73 | |
M2F | 2,4-DINITROPHENYL 2-DEOXY-2-FLUORO- BETA-D-MANNOPYRANOSIDE | A,B | 2WBK | 0.73 | |
NPJ | 4-NITROPHENYL 4-O-ALPHA-D-GLUCOPYRANOSYL- ALPHA-D-GALACTOPYRANOSIDE | A,B,C | 2GGX | 0.74 | |
4BS | 4-amino-N-[4-(benzyloxy)phenyl]butanamide | A | 3CHR | 0.74 | |
EPN | 3-(4-NITRO-PHENOXY)-PROPAN-1-OL | A | 2SAM | 0.81 | |
GAA | METANITROPHENYL-ALPHA-D-GALACTOSIDE | D,E,F,G,H | 1EEI | 0.71 | |
| GAA | METANITROPHENYL-ALPHA-D-GALACTOSIDE | D,E,F,G,H,L, M,N,O,P | 1LT6 | 0.71 | |
4BG | N-[4-(benzyloxy)phenyl]glycinamide | A | 3CHO | 0.75 | |
NCH | P-NITROPHENYL-PHOSPHOCHOLINE | L | 1DL7 | 0.78 | |
KHP | 2-HYDROXYMETHYL-5-(4-NITRO-PHENOXY)- TETRAHYDRO-FURAN-3,4-DIOL | A,B | 1QW9 | 0.73 | |
NPF | ORTHONITROPHENYL-BETA-D-FUCOPYRANOSIDE | A,B,C | 1EFA | 0.73 | |
| NPF | ORTHONITROPHENYL-BETA-D-FUCOPYRANOSIDE | A,B | 2PAF | 0.73 | |
| NPF | ORTHONITROPHENYL-BETA-D-FUCOPYRANOSIDE | A,B,C | 1JWL | 0.73 | |
147 | 1-O-[P-NITROPHENYL]-BETA-D-GALACTOPYRANOSE | A,B,C | 1KRV | 0.74 | |
| 147 | 1-O-[P-NITROPHENYL]-BETA-D-GALACTOPYRANOSE | A,B,C,D | 1JYW | 0.74 | |
N4E | N-(4-ethoxyphenyl)acetamide | A,B,C,D | 3EBS | 0.77 | |
NFG | 2,4-DINITROPHENYL 2-DEOXY-2-FLUORO- BETA-D-GLUCOPYRANOSIDE | A | 2PB1 | 0.73 | |
| NFG | 2,4-DINITROPHENYL 2-DEOXY-2-FLUORO- BETA-D-GLUCOPYRANOSIDE | A | 1E4I | 0.73 | |
| NFG | 2,4-DINITROPHENYL 2-DEOXY-2-FLUORO- BETA-D-GLUCOPYRANOSIDE | A | 1UYQ | 0.73 | |
DCB | 2,4-DINITROPHENYL-2-DEOXY-2-FLUORO- BETA-D-CELLOBIOSIDE | A | 4A3H | 0.72 | |
| DCB | 2,4-DINITROPHENYL-2-DEOXY-2-FLUORO- BETA-D-CELLOBIOSIDE | A | 1H2J | 0.72 | |
EPY | 1-HYDROXY-2-S-GLUTATHIONYL-3-PARA- NITROPHENOXY-PROPANE | A,B,C,D | 1C72 | 0.73 | |
B68 | (2S)-3-[4-(acetylamino)phenoxy]- 2-hydroxy-2-methyl-N-[4-nitro-3- (trifluoromethyl)phenyl]propanamide | A | 3B68 | 0.72 | |
4NS | 4-nitrophenyl sulfate | X | 2ZYU | 0.7 | |
GAT | 4'-AMINOPHENYL-ALPHA-D-GALACTOPYRANOSIDE | D,E,F,G,H | 1EFI | 0.72 | |
NIM | 4-NITRO-2-PHENOXYMETHANESULFONANILIDE | A | 1ZWP | 0.76 | |
| NIM | 4-NITRO-2-PHENOXYMETHANESULFONANILIDE | A | 3E9X | 0.76 | |
| NIM | 4-NITRO-2-PHENOXYMETHANESULFONANILIDE | A | 2OTH | 0.76 | |