Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02396061
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 |
AKT![]() | 10-DECARBOXYMETHYLACLACINOMYCIN T (DCMAT) | A | 1Q0R | 0.71 | ![]() |
CTC![]() | 7-CHLOROTETRACYCLINE | A | 1BJ0 | 0.82 | ![]() |
CTC![]() | 7-CHLOROTETRACYCLINE | A,B | 1BJY | 0.82 | ![]() |
CTC![]() | 7-CHLOROTETRACYCLINE | A | 2FJ1 | 0.82 | ![]() |
CTC![]() | 7-CHLOROTETRACYCLINE | A | 1DU7 | 0.82 | ![]() |
CTC![]() | 7-CHLOROTETRACYCLINE | A,B | 3EGZ | 0.82 | ![]() |
CTC![]() | 7-CHLOROTETRACYCLINE | A | 2TCT | 0.82 | ![]() |
DRA![]() | 11-DEOXY-BETA-RHODOMYCIN | A,B | 1XDS | 0.7 | ![]() |
C39![]() | N-[(2S,4S,5S,7R)-4-AMINO-8-(BUTYLAMINO)- 5-HYDROXY-7-METHYL-2-(1-METHYLETHYL)- 8-OXOOCTYL]-2-(3-METHOXYPROPOXY)BENZAMIDE | C,O | 2V12 | 0.7 | ![]() |
JE2![]() | (R)-N-(2-METHYLBENZYL)-3-[(2S,3S)- 2-HYDROXY-3-(3-HYDROXY-2-METHYLBENZOYL)AMINO- 4-PHENYLBUTANOYL]-5,5-DIMETHYL- 1,3-THIAZOLIDINE-4-CARBOXAMIDE | A,B | 1KZK | 0.7 | ![]() |
JE2![]() | (R)-N-(2-METHYLBENZYL)-3-[(2S,3S)- 2-HYDROXY-3-(3-HYDROXY-2-METHYLBENZOYL)AMINO- 4-PHENYLBUTANOYL]-5,5-DIMETHYL- 1,3-THIAZOLIDINE-4-CARBOXAMIDE | B | 1MSM | 0.7 | ![]() |
JE2![]() | (R)-N-(2-METHYLBENZYL)-3-[(2S,3S)- 2-HYDROXY-3-(3-HYDROXY-2-METHYLBENZOYL)AMINO- 4-PHENYLBUTANOYL]-5,5-DIMETHYL- 1,3-THIAZOLIDINE-4-CARBOXAMIDE | A,B | 2ANL | 0.7 | ![]() |
JE2![]() | (R)-N-(2-METHYLBENZYL)-3-[(2S,3S)- 2-HYDROXY-3-(3-HYDROXY-2-METHYLBENZOYL)AMINO- 4-PHENYLBUTANOYL]-5,5-DIMETHYL- 1,3-THIAZOLIDINE-4-CARBOXAMIDE | B | 1MSN | 0.7 | ![]() |
D2C![]() | (2S,4S,4AR,5AS,6S,11R,11AS,12R,12AR)- 7-CHLORO-4-(DIMETHYLAMINO)-6,10,11,12- TETRAHYDROXY-1,3-DIOXO-1,2,3,4,4A,5,5A,6,11,11A,12,12A- DODECAHYDROTETRACENE-2-CARBOXAMIDE | A,D,M,N,Z | 2F4V | 0.76 | ![]() |
HEH![]() | HEDAMYCIN | A | 1JHI | 0.73 | ![]() |
ARY![]() | ARYLOMYCIN A2 | A,B | 1T7D | 0.72 | ![]() |
ATC![]() | 9-(N,N-DIMETHYLGLYCYLAMIDO)-6-DEOXY- 6-DEMETHYL-TETRACYCLINE | A | 1ORK | 0.75 | ![]() |
HBZ![]() | N-{[(4-hydroxyphenyl)carbonyl]carbamoyl}- beta-D-glucopyranosylamine | A | 2QN7 | 0.7 | ![]() |
BD2![]() | 3-[(4-HYDROXYBENZOYL)AMINO]AZEPAN- 4-YL 4-(2-HYDROXYBENZOYL)BENZOATE | A | 1RE8 | 0.7 | ![]() |
BNR![]() | BIS-DAUNORUBICIN | B | 1AMD | 0.71 | ![]() |
B8L![]() | 3-[(3-SEC-BUTYL-4-HYDROXYBENZOYL)AMINO]AZEPAN- 4-YL 4-(2-HYDROXY-5-METHOXYBENZOYL)BENZOATE | A | 1REK | 0.71 | ![]() |
DM5![]() | IDARUBICIN | A,B,D | 198D | 0.7 | ![]() |
DM5![]() | IDARUBICIN | A | 1D38 | 0.7 | ![]() |
DM5![]() | IDARUBICIN | A | 1D67 | 0.7 | ![]() |
AKY![]() | A,B,C,D | 2IPI | 0.7 | ![]() | |
AKA![]() | 10-DECARBOXYMETHYLACLACINOMYCIN A (DCMAA) | A | 1Q0Z | 0.7 | ![]() |
44D![]() | 7-[5-(4-AMINO-5-HYDROXY-6-METHYL- TETRAHYDRO-PYRAN-2-YLOXY)-4-HYDROXY- 6-METHYL-TETRAHYDRO-PYRAN-2-YLOXY]- 6,9,11-TRIHYDROXY-9-(2-HYDROXY- ACETYL)-7,8,9,10-TETRAHYDRO-NAPHTHACENE- 5,12-DIONE | A,B | 1NAB | 0.7 | ![]() |
DXT![]() | (4S,4AR,5S,5AR,6R,12AS)-4-(DIMETHYLAMINO)- 3,5,10,12,12A-PENTAHYDROXY-6-METHYL- 1,11-DIOXO-1,4,4A,5,5A,6,11,12A- OCTAHYDROTETRACENE-2-CARBOXAMIDE | A | 2O7O | 0.87 | ![]() |
DM4![]() | 1-O-DEMETHYL-6-DEOXYDOXORUBICIN | A | 1D37 | 0.71 | ![]() |
BA1![]() | BALANOL | A | 1BX6 | 0.72 | ![]() |