Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02503082
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 |
5DP | 5-(2,5-dioxopyrrolidin-1-yl)-N- [2-(2-{2-[(4-O-alpha-D-idopyranosyl- alpha-D-mannopyranosyl)oxy]ethoxy}ethoxy)ethyl]pentanamide | A,B,C,D | 3CIU | 0.71 | |
4GP | N-(BETA-D-GLUCOPYRANOSYL)OXAMIC ACID | A | 2F3P | 0.72 | |
AB6 | (2R)-4-AMINO-N-((1R,2S,3R,4R,5S)- 5-AMINO-4-[(2-AMINO-2-DEOXY-ALPHA- D-GLUCOPYRANOSYL)OXY]-2-{2-[(3- AMINOPROPYL)AMINO]ETHOXY}-3-HYDROXYCYCLOHEXYL)- 2-HYDROXYBUTANAMIDE | B | 2F4U | 0.83 | |
76V | N-{[(2S,3S)-3-(ETHOXYCARBONYL)OXIRAN- 2-YL]CARBONYL}-L-ISOLEUCYL-L-ISOLEUCINE | A | 2DCB | 0.7 | |
AMN | 9-DEOXY-9-AMINO-2-O-METHYL-5-N- ACETYL-ALPHA-D-NEURAMINIC ACID | A,B,C,D,E,F | 1HGJ | 0.78 | |
233 | [5-(3,4,5-TRIHYDROXY-6-HYDROXYMETHYL- TETRAHYDRO-PYRAN-2-YLCARBAMOYL)- PENTYL]-CARBAMIC ACID METHYL ESTER | D,E,F,G,H | 1MD2 | 0.72 | |
ASG | 2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE- 4-SULFATE | A | 1RWG | 0.73 | |
ASG | 2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE- 4-SULFATE | A | 1HM2 | 0.73 | |
ASG | 2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE- 4-SULFATE | A | 1RWF | 0.73 | |
ASG | 2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE- 4-SULFATE | A | 1OFL | 0.73 | |
ASG | 2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE- 4-SULFATE | A | 3C9E | 0.73 | |
ASG | 2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE- 4-SULFATE | A | 2C4S | 0.73 | |
ASG | 2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE- 4-SULFATE | A | 1C4S | 0.73 | |
ASG | 2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE- 4-SULFATE | A | 1OFM | 0.73 | |
ASG | 2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE- 4-SULFATE | A | 1OJO | 0.73 | |
ASG | 2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE- 4-SULFATE | A | 1HMW | 0.73 | |
ASG | 2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE- 4-SULFATE | A | 1DQO | 0.73 | |
ASG | 2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE- 4-SULFATE | A | 1HMU | 0.73 | |
ASG | 2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE- 4-SULFATE | A | 1RWH | 0.73 | |
AGH | N-{(1S,2R,3S)-1-[(ALPHA-D-GALACTOPYRANOSYLOXY)METHYL]- 2,3-DIHYDROXYHEPTADECYL}HEXACOSANAMIDE | A | 1ZT4 | 0.72 | |
AGH | N-{(1S,2R,3S)-1-[(ALPHA-D-GALACTOPYRANOSYLOXY)METHYL]- 2,3-DIHYDROXYHEPTADECYL}HEXACOSANAMIDE | A,C,E | 2PO6 | 0.72 | |
042 | N-{[(2S,3S)-3-(ETHOXYCARBONYL)OXIRAN- 2-YL]CARBONYL}-L-THREONYL-L-ISOLEUCINE | A | 2DC7 | 0.71 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A,B,C,D | 2E51 | 0.75 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A | 1D0H | 0.75 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A | 1JOT | 0.75 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A | 1LLP | 0.75 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | X,Y | 2EAL | 0.75 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A,B | 1LU2 | 0.75 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A,B,C,E,F | 2J3F | 0.75 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A | 1LU1 | 0.75 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | D,E,F,G,H,I, J,K,L,M | 3EFX | 0.75 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A | 2VMC | 0.75 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A,B | 2W7Y | 0.75 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A | 1FNZ | 0.75 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A,B,C,D | 2W1U | 0.75 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | F | 2JHI | 0.75 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A,C,E,G | 1M26 | 0.75 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A,B,C,D | 2DTY | 0.75 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A,B | 2J1U | 0.75 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A | 2CCV | 0.75 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A | 2A2D | 0.75 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A | 2AYS | 0.75 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A,B,C,D | 2ZUT | 0.75 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A | 1KYJ | 0.75 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A,B | 2VNG | 0.75 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A,B | 2Z48 | 0.75 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | 1,2,3 | 1BCH | 0.75 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A | 2K33 | 0.75 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A | 2IXB | 0.75 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A,B | 1ULF | 0.75 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A,B | 1JLX | 0.75 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A | 1AX0 | 0.75 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A | 3CA3 | 0.75 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A,B,C,D | 1WMZ | 0.75 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A | 3CA6 | 0.75 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | D,E,G,H | 1LTI | 0.75 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A,B,C,D | 2E7T | 0.75 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | N,O,P,Q,R,S, T,U,V,W | 2O2L | 0.75 | |
AH0 | 2-(2-ACETYLAMINO-4-HYDROXY-6,8- DIOXA-BICYCLO[3.2.1]OCT-3-YLOXY)- PROPIONIC ACID | A | 1QTE | 0.78 | |
AMV | METHYL 2-(ACETYLAMINO)-3-O-[(1R)- 1-CARBOXYETHYL]-2-DEOXY-BETA-D- GLUCOPYRANOSIDE | A | 2J8G | 0.82 | |
AMV | METHYL 2-(ACETYLAMINO)-3-O-[(1R)- 1-CARBOXYETHYL]-2-DEOXY-BETA-D- GLUCOPYRANOSIDE | A | 2J8F | 0.82 | |
ANA | 4-O-ACETYL-ALPHA-2-OMETHYL-5-N- ACETYL-ALPHA-D-NEURAMINIC ACID | A,B,C,D,E,F | 1HGI | 0.77 | |
7GP | ETHYL-N-(BETA-D-GLUCOPYRANOSYL)OXAMATE | A | 2F3S | 0.76 | |
6GP | METHYL-N-(BETA-D-GLUCOPYRANOSYL)OXAMATE | A | 2F3Q | 0.75 | |
16G | N-ACETYL-D-GLUCOSAMINE-6-PHOSPHATE | A,B,D | 1I1D | 0.73 | |
16G | N-ACETYL-D-GLUCOSAMINE-6-PHOSPHATE | A,B | 2DKC | 0.73 | |
16G | N-ACETYL-D-GLUCOSAMINE-6-PHOSPHATE | A,B,C,D,E,F | 1NE7 | 0.73 | |
16G | N-ACETYL-D-GLUCOSAMINE-6-PHOSPHATE | A,B | 1FS5 | 0.73 | |
16G | N-ACETYL-D-GLUCOSAMINE-6-PHOSPHATE | A,B | 2O28 | 0.73 | |
16G | N-ACETYL-D-GLUCOSAMINE-6-PHOSPHATE | A,B | 1FRZ | 0.73 | |
16G | N-ACETYL-D-GLUCOSAMINE-6-PHOSPHATE | A,B | 1HOT | 0.73 | |
16G | N-ACETYL-D-GLUCOSAMINE-6-PHOSPHATE | A | 2VXK | 0.73 | |
AMU | BETA-N-ACETYLMURAMIC ACID | A,B,C,D | 2APH | 0.83 | |
AMU | BETA-N-ACETYLMURAMIC ACID | A,P | 1TWQ | 0.83 | |
AMU | BETA-N-ACETYLMURAMIC ACID | A | 1D0K | 0.83 | |
AMU | BETA-N-ACETYLMURAMIC ACID | S | 9LYZ | 0.83 | |
AMU | BETA-N-ACETYLMURAMIC ACID | E,S | 148L | 0.83 | |
AMU | BETA-N-ACETYLMURAMIC ACID | D,K | 3CYQ | 0.83 | |
AMU | BETA-N-ACETYLMURAMIC ACID | U | 2AIZ | 0.83 | |
AB9 | (2R)-4-AMINO-N-{(1R,2S,3R,4R,5S)- 5-AMINO-2-{2-[(2-AMINOETHYL)AMINO]ETHOXY}- 4-[(2,6-DIAMINO-2,6-DIDEOXY-ALPHA- D-GLUCOPYRANOSYL)OXY]-3-HYDROXYCYCLOHEXYL}- 2-HYDROXYBUTANAMIDE | A,D,M,N,Z | 2F4V | 0.85 | |
AB9 | (2R)-4-AMINO-N-{(1R,2S,3R,4R,5S)- 5-AMINO-2-{2-[(2-AMINOETHYL)AMINO]ETHOXY}- 4-[(2,6-DIAMINO-2,6-DIDEOXY-ALPHA- D-GLUCOPYRANOSYL)OXY]-3-HYDROXYCYCLOHEXYL}- 2-HYDROXYBUTANAMIDE | B | 2F4T | 0.85 | |
AKN | (2R)-4-AMINO-N-{(1R,2S,3S,4R,5S)- 5-AMINO-2-[(3-AMINO-3-DEOXY-ALPHA- D-GLUCOPYRANOSYL)OXY]-4-[(6-AMINO- 6-DEOXY-ALPHA-D-GLUCOPYRANOSYL)OXY]- 3-HYDROXYCYCLOHEXYL}-2-HYDROXYBUTANAMIDE | A,B | 2G5Q | 0.81 | |
AS5 | 2-(acetylamino)-4-O-[2-(acetylamino)- 2-deoxy-alpha-L-gulopyranosyl]- 1,5-anhydro-2-deoxy-D-mannitol | A,B | 2VLC | 0.76 |