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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03221116

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
ASO1,5-ANHYDROSORBITOLA1XIE0.76
ASO1,5-ANHYDROSORBITOLA3GUH0.76
ASO1,5-ANHYDROSORBITOLA,B2ASV0.76
ASO1,5-ANHYDROSORBITOLH,L2EC90.76
FPCD-FRUCTOSE-6-PHOSPHATE (OPEN FORM)A,B1FQO0.73
FPCD-FRUCTOSE-6-PHOSPHATE (OPEN FORM)A,B2GC20.73
XYLD-XYLITOLA,B1XLC0.78
XYLD-XYLITOLA1S5N0.78
XYLD-XYLITOLA1W3Y0.78
XYLD-XYLITOLA1NJR0.78
XYLD-XYLITOLG,H,L2B4C0.78
XYLD-XYLITOLA,B1FX50.78
XYLD-XYLITOLA,B1XLM0.78
XYLD-XYLITOLA,B,C,D1XIN0.78
XYLD-XYLITOLA,B,C,D2XIM0.78
XYLD-XYLITOLA2VFS0.78
XYLD-XYLITOLA,B,C,D1XIM0.78
XYLD-XYLITOLA2XIS0.78
XYLD-XYLITOLA,B1XLG0.78
XYLD-XYLITOLA,B1XLD0.78
XYLD-XYLITOLA1LTE0.78
XYLD-XYLITOLA,B1XLJ0.78
XYLD-XYLITOLA1XIG0.78
XYLD-XYLITOLA,B5XIA0.78
BDFBETA-D-FRUCTOPYRANOSEA1OVP0.71
BDFBETA-D-FRUCTOPYRANOSEA,B1N3Q0.71
BDFBETA-D-FRUCTOPYRANOSEB2FA10.71
GUL5-FLUORO-BETA-L-GULOSYL FLUORIDEA1QWN0.71
GUL5-FLUORO-BETA-L-GULOSYL FLUORIDEA1QWU0.71
LFRBETA-L-FRUCTO-FURANOSEA2CGJ0.71
LFRBETA-L-FRUCTO-FURANOSEA2CGL0.71
LFRBETA-L-FRUCTO-FURANOSEA1ZX50.71
RNTL-RHAMNITOLA,B,C,D1DE50.84
MTLD-MANNITOLA,B1ZZU0.86
MTLD-MANNITOLA,B1ZZQ0.86
MTLD-MANNITOLA,B1M2W0.86
MTLD-MANNITOLA2VFU0.86
GLF1-FLUORO-ALPHA-1-DEOXY-D-GLUCOSEA1CXL0.73
3HD3-O-METHYL-O-ALPHA-D-MANNOPYRANOSYLA2HGO0.74
DTLD-TREITOLA1H160.7
DTLD-TREITOLA1H170.7
DTLD-TREITOLA,C2AAW0.7
DTLD-TREITOLA,B1H180.7
FOCFUCITOLA,B,C,D,E,F1FUI0.84
FRUFRUCTOSEA1FIT0.71
FRUFRUCTOSEA,B,C,D,E,F,
G,H,S,T
3B750.71
FRUFRUCTOSEA,B,C1AF60.71
FRUFRUCTOSEA,B,C2INV0.71
FRUFRUCTOSEA1Y9G0.71
FRUFRUCTOSEA2O510.71
FRUFRUCTOSEA,B1N3P0.71
FRUFRUCTOSEA,B,C,D2HK10.71
FRUFRUCTOSEB,C,F,H,I,K,L2DD40.71
FRUFRUCTOSEA,B,C,D2I580.71
FRUFRUCTOSEA,C1LES0.71
FRUFRUCTOSEA2ADE0.71
FRUFRUCTOSEA,B3BRQ0.71
FRUFRUCTOSEA2HW10.71
FRUFRUCTOSEA2FIT0.71
FRUFRUCTOSEA3FIT0.71
FRUFRUCTOSEA,B1N3Q0.71
FRUFRUCTOSEA2DWJ0.71
BHL6-BROMOHEXAN-1-OLA,B,C1XVB0.73
DG62-DEOXY-GLUCITOL-6-PHOSPHATEA,B1JKI0.73
S6PD-SORBITOL-6-PHOSPHATEA,B2CXQ0.73
S6PD-SORBITOL-6-PHOSPHATEA,B1XTB0.73
S6PD-SORBITOL-6-PHOSPHATEA,B2GC10.73
S6PD-SORBITOL-6-PHOSPHATEA,B,C,D,E,F3CTL0.73
SORD-SORBITOLA1FQA0.86
SORD-SORBITOLA,B,C,D3XIM0.86
SORD-SORBITOLA2VFT0.86
SORD-SORBITOLA,B,C,D5XIM0.86
SORD-SORBITOLA3BRF0.86
SORD-SORBITOLA1XIH0.86
SORD-SORBITOLA2DXR0.86
SORD-SORBITOLA1D8C0.86
SORD-SORBITOLA,B,C,D2XIN0.86
SORD-SORBITOLA1FQB0.86
SORD-SORBITOLA,B4XIA0.86
CBU(1R,2R,3S,4S,5S,6S)-CYCLOHEXANE-
1,2,3,4,5,6-HEXOL
A,B2VT00.82
MRYMESO-ERYTHRITOLA,B1XPG0.7
MRYMESO-ERYTHRITOLA,B1T7L0.7
MRYMESO-ERYTHRITOLA,B1XDJ0.7
MRYMESO-ERYTHRITOLA,B1XR20.7
INS1,2,3,4,5,6-HEXAHYDROXY-CYCLOHEXANEA3BXD0.82
INS1,2,3,4,5,6-HEXAHYDROXY-CYCLOHEXANEA1IEV0.82
INS1,2,3,4,5,6-HEXAHYDROXY-CYCLOHEXANEA1PTG0.82
INS1,2,3,4,5,6-HEXAHYDROXY-CYCLOHEXANEA,B,C2OS90.82
INS1,2,3,4,5,6-HEXAHYDROXY-CYCLOHEXANEA,B,C,D2R710.82
INS1,2,3,4,5,6-HEXAHYDROXY-CYCLOHEXANEA,B1G0I0.82
INS1,2,3,4,5,6-HEXAHYDROXY-CYCLOHEXANEA2HUO0.82
INS1,2,3,4,5,6-HEXAHYDROXY-CYCLOHEXANEA,B1Y7V0.82
INS1,2,3,4,5,6-HEXAHYDROXY-CYCLOHEXANEA1AOD0.82
INS1,2,3,4,5,6-HEXAHYDROXY-CYCLOHEXANEA,B3EA20.82