Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03480454
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 |
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 | |
A16 | 4-O-(4,6-dideoxy-4-{[(1S,2S,3S,4R,5S)- 2,3,4-trihydroxy-5-(hydroxymethyl)cyclohexyl]amino}- alpha-D-glucopyranosyl)-beta-D- glucopyranose | A,B | 2VR5 | 0.83 | |
AMN | 9-DEOXY-9-AMINO-2-O-METHYL-5-N- ACETYL-ALPHA-D-NEURAMINIC ACID | A,B,C,D,E,F | 1HGJ | 0.7 | |
AGH | N-{(1S,2R,3S)-1-[(ALPHA-D-GALACTOPYRANOSYLOXY)METHYL]- 2,3-DIHYDROXYHEPTADECYL}HEXACOSANAMIDE | A | 1ZT4 | 0.73 | |
AGH | N-{(1S,2R,3S)-1-[(ALPHA-D-GALACTOPYRANOSYLOXY)METHYL]- 2,3-DIHYDROXYHEPTADECYL}HEXACOSANAMIDE | A,C,E | 2PO6 | 0.73 | |
AIG | 4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL- TETRAHYDRO-PYRAN-3,5-DIOL | A | 1R7Y | 0.81 | |
AIG | 4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL- TETRAHYDRO-PYRAN-3,5-DIOL | A | 1R7X | 0.81 | |
AIG | 4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL- TETRAHYDRO-PYRAN-3,5-DIOL | A | 1R81 | 0.81 | |
AIG | 4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL- TETRAHYDRO-PYRAN-3,5-DIOL | A | 1R7V | 0.81 | |
AIG | 4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL- TETRAHYDRO-PYRAN-3,5-DIOL | A | 1R80 | 0.81 | |
AM2 | APRAMYCIN | B | 2OE8 | 0.85 | |
AM2 | APRAMYCIN | A,B | 2OE5 | 0.85 | |
AM2 | APRAMYCIN | A,B | 1YRJ | 0.85 | |
AM2 | APRAMYCIN | A,B | 2G5K | 0.85 | |
1GN | 2-DEOXY-2-AMINOGALACTOSE | A,B | 3GAL | 0.79 | |
AH0 | 2-(2-ACETYLAMINO-4-HYDROXY-6,8- DIOXA-BICYCLO[3.2.1]OCT-3-YLOXY)- PROPIONIC ACID | A | 1QTE | 0.77 | |
AMU | BETA-N-ACETYLMURAMIC ACID | A,B,C,D | 2APH | 0.77 | |
AMU | BETA-N-ACETYLMURAMIC ACID | A,P | 1TWQ | 0.77 | |
AMU | BETA-N-ACETYLMURAMIC ACID | A | 1D0K | 0.77 | |
AMU | BETA-N-ACETYLMURAMIC ACID | S | 9LYZ | 0.77 | |
AMU | BETA-N-ACETYLMURAMIC ACID | E,S | 148L | 0.77 | |
AMU | BETA-N-ACETYLMURAMIC ACID | D,K | 3CYQ | 0.77 | |
AMU | BETA-N-ACETYLMURAMIC ACID | U | 2AIZ | 0.77 | |
5AX | 2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY- D-GLUCITOL | A | 2JCQ | 0.74 | |
5AX | 2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY- D-GLUCITOL | A,B | 2IH9 | 0.74 | |
5AX | 2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY- D-GLUCITOL | A,B,C,D,E,F | 2J2P | 0.74 | |
5AX | 2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY- D-GLUCITOL | A | 3DIV | 0.74 | |
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 | 0.81 | |
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 | 0.81 | |
9MR | (3R,4R,5R)-3-HYDROXY-5-(HYDROXYMETHYL)PIPERIDIN- 4-YL BETA-D-GLUCOPYRANOSIDE | A | 3CUF | 0.8 | |
9MR | (3R,4R,5R)-3-HYDROXY-5-(HYDROXYMETHYL)PIPERIDIN- 4-YL BETA-D-GLUCOPYRANOSIDE | A,B | 2OYK | 0.8 | |
AD7 | octyl 3-amino-3-deoxy-2-O-(2,6- dideoxy-alpha-L-lyxo-hexopyranosyl)- beta-D-galactopyranoside | A | 2RJ9 | 0.78 | |
AD7 | octyl 3-amino-3-deoxy-2-O-(2,6- dideoxy-alpha-L-lyxo-hexopyranosyl)- beta-D-galactopyranoside | A | 2RJ4 | 0.78 | |
AGL | 4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE | A | 1CPU | 0.77 | |
AGL | 4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE | A | 1NM9 | 0.77 | |
AGL | 4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE | A | 1MFV | 0.77 | |
AGL | 4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE | A | 1PIG | 0.77 | |
AGL | 4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE | X | 1Z32 | 0.77 | |
AGL | 4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE | A | 1MFU | 0.77 | |
AGL | 4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE | A | 3BLK | 0.77 | |
AGL | 4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE | X | 3BLP | 0.77 | |
AGL | 4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSE | A | 3DHP | 0.77 | |
9CS | (1R,2S,3S,4R,6S)-4,6-DIAMINO-3- [(3-AMINO-3-DEOXY-ALPHA-D-GLUCOPYRANOSYL)OXY]- 2-HYDROXYCYCLOHEXYL 2,6-DIAMINO- 2,6-DIDEOXY-ALPHA-D-GLUCOPYRANOSIDE | A | 2QIR | 0.85 | |
ABL | 6-HYDROXYMETHYL-5-(3,4,5-TRIHYDROXY- 6-HYDROXYMETHYL-TETRAHYDRO-PYRAN- 2-YLOXY)-PIPERIDINE-2,3,4-TRIOL | A,B | 1NAA | 0.87 | |
ABL | 6-HYDROXYMETHYL-5-(3,4,5-TRIHYDROXY- 6-HYDROXYMETHYL-TETRAHYDRO-PYRAN- 2-YLOXY)-PIPERIDINE-2,3,4-TRIOL | A | 2AXR | 0.87 | |
16G | N-ACETYL-D-GLUCOSAMINE-6-PHOSPHATE | A,B,D | 1I1D | 0.77 | |
16G | N-ACETYL-D-GLUCOSAMINE-6-PHOSPHATE | A,B | 2DKC | 0.77 | |
16G | N-ACETYL-D-GLUCOSAMINE-6-PHOSPHATE | A,B,C,D,E,F | 1NE7 | 0.77 | |
16G | N-ACETYL-D-GLUCOSAMINE-6-PHOSPHATE | A,B | 1FS5 | 0.77 | |
16G | N-ACETYL-D-GLUCOSAMINE-6-PHOSPHATE | A,B | 2O28 | 0.77 | |
16G | N-ACETYL-D-GLUCOSAMINE-6-PHOSPHATE | A,B | 1FRZ | 0.77 | |
16G | N-ACETYL-D-GLUCOSAMINE-6-PHOSPHATE | A,B | 1HOT | 0.77 | |
16G | N-ACETYL-D-GLUCOSAMINE-6-PHOSPHATE | A | 2VXK | 0.77 | |
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 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A,B,C,D | 2E51 | 0.82 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A | 1D0H | 0.82 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A | 1JOT | 0.82 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A | 1LLP | 0.82 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | X,Y | 2EAL | 0.82 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A,B | 1LU2 | 0.82 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A,B,C,E,F | 2J3F | 0.82 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A | 1LU1 | 0.82 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | D,E,F,G,H,I, J,K,L,M | 3EFX | 0.82 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A | 2VMC | 0.82 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A,B | 2W7Y | 0.82 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A | 1FNZ | 0.82 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A,B,C,D | 2W1U | 0.82 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | F | 2JHI | 0.82 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A,C,E,G | 1M26 | 0.82 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A,B,C,D | 2DTY | 0.82 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A,B | 2J1U | 0.82 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A | 2CCV | 0.82 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A | 2A2D | 0.82 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A | 2AYS | 0.82 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A,B,C,D | 2ZUT | 0.82 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A | 1KYJ | 0.82 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A,B | 2VNG | 0.82 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A,B | 2Z48 | 0.82 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | 1,2,3 | 1BCH | 0.82 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A | 2K33 | 0.82 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A | 2IXB | 0.82 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A,B | 1ULF | 0.82 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A,B | 1JLX | 0.82 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A | 1AX0 | 0.82 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A | 3CA3 | 0.82 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A,B,C,D | 1WMZ | 0.82 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A | 3CA6 | 0.82 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | D,E,G,H | 1LTI | 0.82 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | A,B,C,D | 2E7T | 0.82 | |
A2G | N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE | N,O,P,Q,R,S, T,U,V,W | 2O2L | 0.82 | |
ABD | ACARBOSE DERIVED HEXASACCHARIDE | A | 1QHO | 0.8 |