Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02491596
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 |
9AR | 9-HYDROXY ARISTOLOCHIC ACID | A,B | 1FV0 | 0.81 | |
NOV | NOVOBIOCIN | A,B | 1KIJ | 0.71 | |
NOV | NOVOBIOCIN | A,B | 1S14 | 0.71 | |
NOV | NOVOBIOCIN | A | 1AJ6 | 0.71 | |
ERT | METHYL (4R)-2-ETHYL-2,5,12-TRIHYDROXY- 7-METHOXY-6,11-DIOXO-4-{[2,3,6- TRIDEOXY-3-(DIMETHYLAMINO)-BETA- D-RIBO-HEXOPYRANOSYL]OXY}-1H,2H,3H,4H,6H,11H- TETRACENE-1-CARBOXYLATE | A,B | 1TW2 | 0.7 | |
ERT | METHYL (4R)-2-ETHYL-2,5,12-TRIHYDROXY- 7-METHOXY-6,11-DIOXO-4-{[2,3,6- TRIDEOXY-3-(DIMETHYLAMINO)-BETA- D-RIBO-HEXOPYRANOSYL]OXY}-1H,2H,3H,4H,6H,11H- TETRACENE-1-CARBOXYLATE | A,B | 1TW3 | 0.7 | |
DM1 | DAUNOMYCIN | A | 152D | 0.71 | |
DM1 | DAUNOMYCIN | A,B,C,D | 1O0K | 0.71 | |
DM1 | DAUNOMYCIN | A | 1JO2 | 0.71 | |
DM1 | DAUNOMYCIN | A,B | 308D | 0.71 | |
DM1 | DAUNOMYCIN | A | 1D33 | 0.71 | |
DM1 | DAUNOMYCIN | A | 110D | 0.71 | |
DM1 | DAUNOMYCIN | A | 1D11 | 0.71 | |
DM1 | DAUNOMYCIN | A | 427D | 0.71 | |
DM1 | DAUNOMYCIN | A | 2D34 | 0.71 | |
DM1 | DAUNOMYCIN | A | 3F8F | 0.71 | |
DM1 | DAUNOMYCIN | A | 1D10 | 0.71 | |
DM1 | DAUNOMYCIN | A | 1DA0 | 0.71 | |
MOB | A,B | 1SRH | 0.74 | ||
DM3 | 6-DEOXYDAUNOMYCIN | A | 1D14 | 0.71 | |
4BC | 4-(1,3-BENZODIOXOL-5-YL)-5-(5-ETHYL- 2,4-DIHYDROXYPHENYL)-2H-PYRAZOLE- 3-CARBOXYLIC ACID | A | 1YC3 | 0.71 | |
4BC | 4-(1,3-BENZODIOXOL-5-YL)-5-(5-ETHYL- 2,4-DIHYDROXYPHENYL)-2H-PYRAZOLE- 3-CARBOXYLIC ACID | A | 1YC1 | 0.71 | |
DM6 | 4'-EPIDOXORUBICIN | A | 1D15 | 0.71 | |
DM6 | 4'-EPIDOXORUBICIN | A | 1D54 | 0.71 | |
DM6 | 4'-EPIDOXORUBICIN | A | 1D58 | 0.71 | |
DM6 | 4'-EPIDOXORUBICIN | A | 1QDA | 0.71 | |
DM2 | DOXORUBICIN | A | 2DR6 | 0.71 | |
DM2 | DOXORUBICIN | A | 1P20 | 0.71 | |
DM2 | DOXORUBICIN | A | 1I1E | 0.71 | |
DM2 | DOXORUBICIN | A | 151D | 0.71 | |
DM2 | DOXORUBICIN | A | 1D12 | 0.71 | |
DM2 | DOXORUBICIN | A | 1DA9 | 0.71 | |
44C | A | 2FBR | 0.71 | ||
D27 | 2-{[(2E)-3-(3,4-dimethoxyphenyl)prop- 2-enoyl]amino}benzoic acid | A,B,C,D | 2VD0 | 0.7 | |
RDE | 2-(3-AMINO-2,5,6-TRIMETHOXYPHENYL)ETHYL 5- CHLORO-2,4-DIHYDROXYBENZOATE | A,B | 2FYP | 0.71 | |
RDE | 2-(3-AMINO-2,5,6-TRIMETHOXYPHENYL)ETHYL 5- CHLORO-2,4-DIHYDROXYBENZOATE | A | 1ZWH | 0.71 | |
MR2 | 3-DIPHENOL-6-NITRO-3H-BENZO[DE]ISOCHROMEN- 1-ONE | A | 1TSM | 0.72 | |
6CA | A | 2FLM | 0.7 | ||
FLG | FLUORESCEINYLTHIOUREIDO | A,B | 1OCB | 0.7 | |
FLQ | N-[6-(ACETYLAMINO)HEXYL]-3',6'- DIHYDROXY-3-OXO-3H-SPIRO[2-BENZOFURAN- 1,9'-XANTHENE]-6-CARBOXAMIDE | C | 2FDC | 0.71 | |
EH5 | N-(1-BENZYL-3-{[3-(1,3-DIOXO-1,3- DIHYDRO-ISOINDOL-2-YL)-PROPIONYL]- [2-(HEXAHYDRO-BENZO[1,3]DIOXOL- 5-YL)-ETHYL]-AMINO}-2-HYDROXY-PROPYL)- 4-BENZYLOXY-3,5-DIMETHOXY-BENZAMIDE | A | 1LF3 | 0.73 | |
POD | 9-HYDROXY-5-(3,4,5-TRIMETHOXYPHENYL)- 5,8,8A,9-TETRAHYDROFURO[3',4':6,7]NAPHTHO[2,3- D][1,3]DIOXOL-6(5AH)-ONE | A,B,C,D | 1SA1 | 0.78 |