Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03177219
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 |
BGS![]() | BETA-D-GLUCOPYRANOSYLSULFONYLETHANE | A | 2B5Z | 0.82 | ![]() |
SOG![]() | 2-HYDROXYMETHYL-6-OCTYLSULFANYL- TETRAHYDRO-PYRAN-3,4,5-TRIOL | A | 1J2Z | 0.85 | ![]() |
SOG![]() | 2-HYDROXYMETHYL-6-OCTYLSULFANYL- TETRAHYDRO-PYRAN-3,4,5-TRIOL | A,B | 1VA5 | 0.85 | ![]() |
SOG![]() | 2-HYDROXYMETHYL-6-OCTYLSULFANYL- TETRAHYDRO-PYRAN-3,4,5-TRIOL | A,B,C,D | 2VT4 | 0.85 | ![]() |
WZ1![]() | methyl 3-S-alpha-D-mannopyranosyl- 3-thio-alpha-D-mannopyranoside | A | 3BVT | 0.77 | ![]() |
SSO![]() | 1,4-DIDEOXY-1,4-[[2S,3S)-2,4-DIHYDROXY- 3-(SULFOXY)BUTYL]EPISULFONIUMYLIDENE]- D-ARABINITOL INNER SALT | A | 1TQS | 0.77 | ![]() |
10M![]() | decyl 4-O-alpha-D-glucopyranosyl- 1-thio-beta-D-glucopyranoside | A | 3C5T | 0.72 | ![]() |
10M![]() | decyl 4-O-alpha-D-glucopyranosyl- 1-thio-beta-D-glucopyranoside | A,B | 3C59 | 0.72 | ![]() |
MA2![]() | 4-S-methyl-4-thio-alpha-D-glucopyranose | A | 1JFH | 0.75 | ![]() |
GS1![]() | 1-THIO-BETA-D-GLUCOPYRANOSE | A,B | 1KFG | 0.74 | ![]() |
TDG![]() | THIODIGALACTOSIDE | A,B | 1PV7 | 0.82 | ![]() |
TDG![]() | THIODIGALACTOSIDE | A,B | 1A78 | 0.82 | ![]() |
TDG![]() | THIODIGALACTOSIDE | D,E,F,G,H | 1LT5 | 0.82 | ![]() |
TDG![]() | THIODIGALACTOSIDE | A,B,C,D,E | 1MUQ | 0.82 | ![]() |
SMD![]() | METHYL-2-S-(ALPHA-D-MANNOPYRANOSYL)- 2-THIO-ALPHA-D-MANNOPYRANOSIDE | A | 1X9D | 0.77 | ![]() |
FSA![]() | 1-S-(carboxymethyl)-1-thio-beta- D-fructopyranose | A,B | 3DJE | 0.75 | ![]() |
MA1![]() | 1,4-dithio-alpha-D-glucopyranose | A | 1JFH | 0.75 | ![]() |
TCB![]() | THIOCELLOBIOSE | A | 2O9R | 0.75 | ![]() |
TCB![]() | THIOCELLOBIOSE | A | 1IEX | 0.75 | ![]() |
WZ2![]() | methyl alpha-D-mannopyranosyl-(1- >3)-[alpha-D-mannopyranosyl-(1- >6)]-3-thio-alpha-D-mannopyranoside | A | 3BVU | 0.72 | ![]() |
IPT![]() | ISOPROPYL-1-BETA-D-THIOGALACTOSIDE | A,B | 1NA0 | 0.88 | ![]() |
IPT![]() | ISOPROPYL-1-BETA-D-THIOGALACTOSIDE | A,B,C,D | 1LBH | 0.88 | ![]() |
IPT![]() | ISOPROPYL-1-BETA-D-THIOGALACTOSIDE | A,B,C,D | 1TLF | 0.88 | ![]() |
IPT![]() | ISOPROPYL-1-BETA-D-THIOGALACTOSIDE | A,B | 1NA3 | 0.88 | ![]() |
IPT![]() | ISOPROPYL-1-BETA-D-THIOGALACTOSIDE | A,B,C,D | 1PX4 | 0.88 | ![]() |
IPT![]() | ISOPROPYL-1-BETA-D-THIOGALACTOSIDE | A,B,C | 1KRU | 0.88 | ![]() |
IPT![]() | ISOPROPYL-1-BETA-D-THIOGALACTOSIDE | A,B,C,D | 3DYO | 0.88 | ![]() |
IPT![]() | ISOPROPYL-1-BETA-D-THIOGALACTOSIDE | A,B | 2P9H | 0.88 | ![]() |
IPT![]() | ISOPROPYL-1-BETA-D-THIOGALACTOSIDE | A,B,C,D | 1JYX | 0.88 | ![]() |
GLT![]() | 5-DEOXY-5-THIO-ALPHA-D-GLUCOSE | A,B | 1XLI | 0.8 | ![]() |
SSD![]() | 1,4-DIDEOXY-1,4-[[2R,3R)-2,4-DIHYDROXY- 3-(SULFOXY)BUTYL]EPISULFONIUMYLIDENE]- D-ARABINITOL INNER SALT | A | 1TQT | 0.77 | ![]() |
HTG![]() | HEPTYL 1-THIOHEXOPYRANOSIDE | B | 2PL7 | 0.87 | ![]() |
HTG![]() | HEPTYL 1-THIOHEXOPYRANOSIDE | F,H | 2PL6 | 0.87 | ![]() |
HTG![]() | HEPTYL 1-THIOHEXOPYRANOSIDE | A,B | 1U19 | 0.87 | ![]() |
HTG![]() | HEPTYL 1-THIOHEXOPYRANOSIDE | A | 2VNJ | 0.87 | ![]() |
HTG![]() | HEPTYL 1-THIOHEXOPYRANOSIDE | A,B,C,D,E,F, G,H | 3EJE | 0.87 | ![]() |
HTG![]() | HEPTYL 1-THIOHEXOPYRANOSIDE | A,B | 2G87 | 0.87 | ![]() |
HTG![]() | HEPTYL 1-THIOHEXOPYRANOSIDE | A,B | 2PED | 0.87 | ![]() |
HTG![]() | HEPTYL 1-THIOHEXOPYRANOSIDE | A | 2VNI | 0.87 | ![]() |
HTG![]() | HEPTYL 1-THIOHEXOPYRANOSIDE | A,B,C,D,E,F, G,H | 3EJB | 0.87 | ![]() |
HTG![]() | HEPTYL 1-THIOHEXOPYRANOSIDE | A | 2VNH | 0.87 | ![]() |
HTG![]() | HEPTYL 1-THIOHEXOPYRANOSIDE | A | 2BGI | 0.87 | ![]() |
HTG![]() | HEPTYL 1-THIOHEXOPYRANOSIDE | A,B,C,D,E,F, G,H | 3EJD | 0.87 | ![]() |
HTG![]() | HEPTYL 1-THIOHEXOPYRANOSIDE | A,B | 2HPY | 0.87 | ![]() |
DP5![]() | 1,4-DIMERCAPTO-ALPHA-D-GLUCOPYRANOSYL- (1-4)-S-1,4-DIMERCAPTO-BETA-D-GLUCOPYRANOSYL- (1-4)-S-1,4-DIMERCAPTO-BETA-D-GLUCOPYRANOSE | A,B,C,D | 1OVW | 0.75 | ![]() |
SSG![]() | 1,4-DEOXY-1,4-DITHIO-BETA-D-GLUCOPYRANOSE | A | 1F9O | 0.75 | ![]() |
SSG![]() | 1,4-DEOXY-1,4-DITHIO-BETA-D-GLUCOPYRANOSE | A | 1OCJ | 0.75 | ![]() |
SSG![]() | 1,4-DEOXY-1,4-DITHIO-BETA-D-GLUCOPYRANOSE | A | 1UOZ | 0.75 | ![]() |
SSG![]() | 1,4-DEOXY-1,4-DITHIO-BETA-D-GLUCOPYRANOSE | A | 1H5V | 0.75 | ![]() |