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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02813164

You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
GLR2,3-DIHYDROXY-5-OXO-HEXANEDIOATEA,B,C,D1EC80.88
GLR2,3-DIHYDROXY-5-OXO-HEXANEDIOATEA,B,C,D1JDF0.88
3LR3,6-dideoxy-L-arabino-hexonic acidA,B3CXO0.75
DXG4-DEOXYGLUCARATEA,B,C,D1ECQ0.81
GLOD-GLUCOSE IN LINEAR FORMA,B1XYB0.72
GLOD-GLUCOSE IN LINEAR FORMA1FQD0.72
GLOD-GLUCOSE IN LINEAR FORMA,B1XYM0.72
GLOD-GLUCOSE IN LINEAR FORMA,B1EZ90.72
GLOD-GLUCOSE IN LINEAR FORMA1FBO0.72
GLOD-GLUCOSE IN LINEAR FORMA1AC00.72
GLOD-GLUCOSE IN LINEAR FORMA1FQC0.72
149D-GALCTOPYRANOSYL-1-ONA,B,C,D1JZ50.74
149D-GALCTOPYRANOSYL-1-ONA,B,C,D3CZJ0.74
DHD2,4-DIOXO-PENTANEDIOIC ACIDA,B,C,D1CS10.71
3HG3-HYDROXYPENTANEDIOIC ACIDA,B,C,D,E,F2CW60.75
6PG6-PHOSPHOGLUCONIC ACIDA1PGP0.71
6PG6-PHOSPHOGLUCONIC ACIDA,B1J3R0.71
6PG6-PHOSPHOGLUCONIC ACIDA,B1QY40.71
6PG6-PHOSPHOGLUCONIC ACIDA,B2W8Z0.71
6PG6-PHOSPHOGLUCONIC ACIDA,B3E7F0.71
6PG6-PHOSPHOGLUCONIC ACIDA,B2W900.71
6PG6-PHOSPHOGLUCONIC ACIDA,B1KO80.71
6PG6-PHOSPHOGLUCONIC ACIDA,B2CXR0.71
6PG6-PHOSPHOGLUCONIC ACIDA2IYO0.71
6PG6-PHOSPHOGLUCONIC ACIDA,B1DQR0.71
1N5(2R,4S)-2,4,7-trihydroxyheptanoic acidA,B3CXO0.75
DNOD-mannoseA3BDK0.72
GKRD-GLUCARATEA3CXT0.79
GKRD-GLUCARATEA,B1JCT0.79
AKG2-OXYGLUTARIC ACIDA,B,C,D1YBA0.72
AKG2-OXYGLUTARIC ACIDA1DS10.72
AKG2-OXYGLUTARIC ACIDA1H2L0.72
AKG2-OXYGLUTARIC ACIDA,B,C1NX80.72
AKG2-OXYGLUTARIC ACIDA,B3BUC0.72
AKG2-OXYGLUTARIC ACIDA2RDN0.72
AKG2-OXYGLUTARIC ACIDA,B3BIE0.72
AKG2-OXYGLUTARIC ACIDA,D1OIK0.72
AKG2-OXYGLUTARIC ACIDA,B,C,D3DC10.72
AKG2-OXYGLUTARIC ACIDA,B2FDF0.72
AKG2-OXYGLUTARIC ACIDA3D8C0.72
AKG2-OXYGLUTARIC ACIDA1DRY0.72
AKG2-OXYGLUTARIC ACIDA,B2FDH0.72
AKG2-OXYGLUTARIC ACIDA,B,C2J9E0.72
AKG2-OXYGLUTARIC ACIDA,B,C,D,E,F2QFY0.72
AKG2-OXYGLUTARIC ACIDA1UNB0.72
AKG2-OXYGLUTARIC ACIDA,B,C,D1OIJ0.72
AKG2-OXYGLUTARIC ACIDA,B,C,D,E,F2QFX0.72
AKG2-OXYGLUTARIC ACIDA,B1GQW0.72
AKG2-OXYGLUTARIC ACIDA,B3BKZ0.72
AKG2-OXYGLUTARIC ACIDA,B2GP50.72
AKG2-OXYGLUTARIC ACIDA,B3GJB0.72
AKG2-OXYGLUTARIC ACIDA1GP40.72
AKG2-OXYGLUTARIC ACIDA2RDQ0.72
AKG2-OXYGLUTARIC ACIDA,B,C,D,E,F1HWY0.72
AKG2-OXYGLUTARIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
2VDC0.72
AKG2-OXYGLUTARIC ACIDA,B3BU00.72
AKG2-OXYGLUTARIC ACIDA,B2FCT0.72
AKG2-OXYGLUTARIC ACIDA,B,F,G2Q8C0.72
AKG2-OXYGLUTARIC ACIDA,B1GY90.72
AKG2-OXYGLUTARIC ACIDA,B,C,D1OII0.72
AKG2-OXYGLUTARIC ACIDA2A1X0.72
AKG2-OXYGLUTARIC ACIDA1H2N0.72
AKG2-OXYGLUTARIC ACIDA,B,C1NX40.72
AKG2-OXYGLUTARIC ACIDA2BRT0.72
AKG2-OXYGLUTARIC ACIDA,B2FCV0.72
AKG2-OXYGLUTARIC ACIDA,B2FDI0.72
AKG2-OXYGLUTARIC ACIDA2YU10.72
AKG2-OXYGLUTARIC ACIDA,B2FDK0.72
AKG2-OXYGLUTARIC ACIDA1E5I0.72
AKG2-OXYGLUTARIC ACIDA1UOB0.72
AKG2-OXYGLUTARIC ACIDA,B1OFE0.72
AKG2-OXYGLUTARIC ACIDA2ILM0.72
AKG2-OXYGLUTARIC ACIDA,B2FCU0.72
AKG2-OXYGLUTARIC ACIDA,B1AIB0.72
AKG2-OXYGLUTARIC ACIDA1RXG0.72
AKG2-OXYGLUTARIC ACIDA1MZF0.72
AKG2-OXYGLUTARIC ACIDA,B1EA00.72
AKG2-OXYGLUTARIC ACIDA1DRT0.72
AKG2-OXYGLUTARIC ACIDA2IUW0.72
AKG2-OXYGLUTARIC ACIDA,B,C,D3BN10.72
AKG2-OXYGLUTARIC ACIDA,B2FD80.72
AKG2-OXYGLUTARIC ACIDA2JJH0.72
AKG2-OXYGLUTARIC ACIDA1IKA0.72
AKG2-OXYGLUTARIC ACIDA,B,C,D1OS70.72
AKG2-OXYGLUTARIC ACIDA1MDX0.72
AKG2-OXYGLUTARIC ACIDA,B1OFD0.72
AKG2-OXYGLUTARIC ACIDA2CJH0.72
AKG2-OXYGLUTARIC ACIDA1GP50.72
AKG2-OXYGLUTARIC ACIDA1CW40.72
AKG2-OXYGLUTARIC ACIDA,B3BI30.72
AKG2-OXYGLUTARIC ACIDA1BL50.72
AKG2-OXYGLUTARIC ACIDA1LLW0.72
AKG2-OXYGLUTARIC ACIDA2ZE30.72
AKG2-OXYGLUTARIC ACIDA1GVG0.72
DO42,5-DIOXOPENTANOIC ACIDX2Q1D0.73
AOSD-ALLOSEA,B,C,D2I570.72
GC12,6-ANHYDRO-L-GULONIC ACIDA1HUA0.72
GCOGLUCONIC ACIDB,C,D1BGG0.81
GCOGLUCONIC ACIDA,B1XLF0.81
DMR2-HYDROXY-SUCCINIC ACIDA,B2YZO0.75
DMR2-HYDROXY-SUCCINIC ACIDA4CSC0.75
DMR2-HYDROXY-SUCCINIC ACIDH,L1C1E0.75
DMR2-HYDROXY-SUCCINIC ACIDA2CSC0.75
DMR2-HYDROXY-SUCCINIC ACIDA2AR90.75
CS2D-MANNONIC ACIDA,B,C,D2QJM0.81
CS2D-MANNONIC ACIDA,B3DBN0.81
FUDD-fructoseA,B,C,D2QUN0.76
3MF3-O-METHYLFRUCTOSE IN LINEAR FORMA,B1XYC0.71