Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03289098
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 |
UDC | (2S,3S)-2-((2S,3R,4S,5R)-5-ETHANAMIDO- 3-HYDROXY-2-(HYDROXYMETHYL)TETRAHYDRO- 2H-PYRAN-4-YLOXY)-3,4-DIHYDROXY- 2-METHYLBUTANOIC ACID | A,B,C,D | 2Z2C | 0.71 | |
CR6 | 1-DEOXY-1-ACETYLAMINO-BETA-D-GLUCO- 2-HEPTULOPYRANOSONAMIDE | A | 1P4H | 0.76 | |
CR6 | 1-DEOXY-1-ACETYLAMINO-BETA-D-GLUCO- 2-HEPTULOPYRANOSONAMIDE | A | 1FU8 | 0.76 | |
NAU | 4,4,6,7,8,9-HEXAHYDROXY-5-METHYLCARBOXAMIDONONANOIC ACID | A,C | 1F7B | 0.74 | |
F34 | N-[(3S,4R,5R,6R)-4,5,6-trihydroxyazepan- 3-yl]acetamide | A,B | 2W67 | 0.74 | |
233 | [5-(3,4,5-TRIHYDROXY-6-HYDROXYMETHYL- TETRAHYDRO-PYRAN-2-YLCARBAMOYL)- PENTYL]-CARBAMIC ACID METHYL ESTER | D,E,F,G,H | 1MD2 | 0.77 | |
GDL | 2-ACETAMIDO-2-DEOXY-D-GLUCONO-1,5- LACTONE | A,B | 1UR9 | 0.75 | |
GDL | 2-ACETAMIDO-2-DEOXY-D-GLUCONO-1,5- LACTONE | A,B,C,D,E,F | 1O7A | 0.75 | |
GDL | 2-ACETAMIDO-2-DEOXY-D-GLUCONO-1,5- LACTONE | A,B | 1UR8 | 0.75 | |
W72 | 6-DEOXY-6-[(2R,3R,4R)-3,4-DIHYDROXY- 2-(HYDROXYMETHYL)PYRROLIDIN-1-YL]- L-GULONIC ACID | A | 2FYV | 0.74 | |
DT6 | 2,4-BIS(ACETYLAMINO)-1,5-ANHYDRO- 2,4-DIDEOXY-D-GLUCITOL | A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P,Q,R | 2HIL | 0.7 | |
DT6 | 2,4-BIS(ACETYLAMINO)-1,5-ANHYDRO- 2,4-DIDEOXY-D-GLUCITOL | A | 2HI2 | 0.7 | |
MG8 | N-OCTANOYL-N-METHYLGLUCAMINE | A,B | 1SMH | 0.75 | |
MG8 | N-OCTANOYL-N-METHYLGLUCAMINE | A | 1Q61 | 0.75 | |
MG8 | N-OCTANOYL-N-METHYLGLUCAMINE | A | 1Q8U | 0.75 | |
MG8 | N-OCTANOYL-N-METHYLGLUCAMINE | A | 1SVE | 0.75 | |
DL6 | 2-AZIDO-N-((2R,3R,4S,5S,6R)-3,4,5- TRIHYDROXY-6-(HYDROXYMETHYL)-TETRAHYDRO- 2H-PYRAN-2-YL)ACETAMIDE | A | 2FFR | 0.74 | |
NAV | 6,7,8,9-TETRAHYDROXY-5-METHYLCARBOXAMIDO- 4-OXONONANOIC ACID | A,C | 1F7B | 0.73 | |
NBG | 1-N-ACETYL-BETA-D-GLUCOSAMINE | A,B | 1L5Q | 0.73 | |
NBG | 1-N-ACETYL-BETA-D-GLUCOSAMINE | A,B | 3CEM | 0.73 | |
NBG | 1-N-ACETYL-BETA-D-GLUCOSAMINE | A,B | 1L5R | 0.73 | |
NBG | 1-N-ACETYL-BETA-D-GLUCOSAMINE | A,B | 1EXV | 0.73 | |
NBG | 1-N-ACETYL-BETA-D-GLUCOSAMINE | A,B | 1L5S | 0.73 | |
NBG | 1-N-ACETYL-BETA-D-GLUCOSAMINE | A,B | 1L7X | 0.73 | |
NBG | 1-N-ACETYL-BETA-D-GLUCOSAMINE | A | 1WW2 | 0.73 | |
NBG | 1-N-ACETYL-BETA-D-GLUCOSAMINE | A | 2PRJ | 0.73 | |
NBG | 1-N-ACETYL-BETA-D-GLUCOSAMINE | A,B | 1FC0 | 0.73 | |
NBG | 1-N-ACETYL-BETA-D-GLUCOSAMINE | A,B | 3CEJ | 0.73 | |
NBG | 1-N-ACETYL-BETA-D-GLUCOSAMINE | A,B | 3CEH | 0.73 | |
NBG | 1-N-ACETYL-BETA-D-GLUCOSAMINE | A,B | 1XOI | 0.73 | |
NBG | 1-N-ACETYL-BETA-D-GLUCOSAMINE | A,B | 3DDW | 0.73 | |
NBG | 1-N-ACETYL-BETA-D-GLUCOSAMINE | A,B | 1EM6 | 0.73 | |
NBG | 1-N-ACETYL-BETA-D-GLUCOSAMINE | A,B | 3DDS | 0.73 | |
NBG | 1-N-ACETYL-BETA-D-GLUCOSAMINE | A,B | 3DD1 | 0.73 | |
HQ6 | N-[(3R,4S,5R,6R,7R)-3,5,6-trihydroxy- 7-(hydroxymethyl)azepan-4-yl]acetamide | A,B | 2W66 | 0.71 | |
NAY | 6,7,8,9-TETRAHYDROXY-5-METHYLCARBOXAMIDO- 2-OXONONANOIC ACID | A,C | 1F74 | 0.74 | |
NTF | N-TRIFLURO-ACETYL-BETA-D-GLUCOPYRANOSYLAMINE | A | 1WW3 | 0.7 | |
IFL | (3S,4R,5R)-3,4-DIHYDROXY-5-(HYDROXYMETHYL)PIPERIDIN- 2-ONE | A,B | 1UZ1 | 0.76 | |
IFL | (3S,4R,5R)-3,4-DIHYDROXY-5-(HYDROXYMETHYL)PIPERIDIN- 2-ONE | A | 2V38 | 0.76 | |
IFL | (3S,4R,5R)-3,4-DIHYDROXY-5-(HYDROXYMETHYL)PIPERIDIN- 2-ONE | A,B | 2VJX | 0.76 | |
IFL | (3S,4R,5R)-3,4-DIHYDROXY-5-(HYDROXYMETHYL)PIPERIDIN- 2-ONE | A | 1UZ4 | 0.76 | |
HG9 | 1-DEOXY-1-[(2-HYDROXYETHYL)(NONANOYL)AMINO]HEXITOL | A,B,C,D | 1SO2 | 0.73 | |
4GP | N-(BETA-D-GLUCOPYRANOSYL)OXAMIC ACID | A | 2F3P | 0.71 | |
NOK | 2-ACETAMIDO-1,2-DIDEOXYNOJIRMYCIN | A | 2VC9 | 0.76 | |
HMN | 2,4,6,7,8,9-HEXAHYDROXY-5-METHYLCARBOXAMIDO NONANOIC ACID | A,B,C,D | 1F73 | 0.77 | |
8GP | A | 2F3U | 0.72 | ||
CRA | 1-DEOXY-1-METHOXYCARBAMIDO-BETA- D-GLUCO-2-HEPTULOPYRANOSONAMIDE | A | 1FS4 | 0.73 | |
CRA | 1-DEOXY-1-METHOXYCARBAMIDO-BETA- D-GLUCO-2-HEPTULOPYRANOSONAMIDE | A | 1B4D | 0.73 | |
NGC | 3,5-dideoxy-5-[(hydroxyacetyl)amino]- D-glycero-alpha-D-galacto-non-2- ulopyranosonic acid | A,B,C,D,E | 3DWP | 0.7 | |
NGC | 3,5-dideoxy-5-[(hydroxyacetyl)amino]- D-glycero-alpha-D-galacto-non-2- ulopyranosonic acid | A,B,C,D,E | 3DWQ | 0.7 | |
BGN | N-BUTANOYL-2-AMINO-2-DEOXY-GLUCOPYRANOSIDE | A,B,C,D | 1NWG | 0.7 |