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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03921617

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
BDPBETA-D-GALACTOPYRANURONIC ACIDA1N7R0.89
BDPBETA-D-GALACTOPYRANURONIC ACIDA3C9E0.89
BDPBETA-D-GALACTOPYRANURONIC ACIDA1LOH0.89
BDPBETA-D-GALACTOPYRANURONIC ACIDA1CAP0.89
BDPBETA-D-GALACTOPYRANURONIC ACIDA1HM30.89
BDPBETA-D-GALACTOPYRANURONIC ACIDA1HUA0.89
BDPBETA-D-GALACTOPYRANURONIC ACIDA1LXK0.89
BDPBETA-D-GALACTOPYRANURONIC ACIDA,B1GQK0.89
BDPBETA-D-GALACTOPYRANURONIC ACIDA,B1ON80.89
BDPBETA-D-GALACTOPYRANURONIC ACIDP2BVK0.89
BDPBETA-D-GALACTOPYRANURONIC ACIDA2JCR0.89
BDPBETA-D-GALACTOPYRANURONIC ACIDA1LXM0.89
BDPBETA-D-GALACTOPYRANURONIC ACIDA1HMW0.89
BDPBETA-D-GALACTOPYRANURONIC ACIDA3HYA0.89
BDPBETA-D-GALACTOPYRANURONIC ACIDA,B1GQL0.89
BDPBETA-D-GALACTOPYRANURONIC ACIDA1OFM0.89
BDPBETA-D-GALACTOPYRANURONIC ACIDA1N7Q0.89
20SBETA-D-FRUCTOFURANOSYL 6-O-OCTANOYL-
ALPHA-D-GLUCOPYRANOSIDE		A,B2FAF0.74
20SBETA-D-FRUCTOFURANOSYL 6-O-OCTANOYL-
ALPHA-D-GLUCOPYRANOSIDE		A,B,C,D2FAH0.74
20SBETA-D-FRUCTOFURANOSYL 6-O-OCTANOYL-
ALPHA-D-GLUCOPYRANOSIDE		A,B2QZY0.74
CS2D-MANNONIC ACIDA,B,C,D2QJM0.74
CS2D-MANNONIC ACIDA,B3DBN0.74
CEG4,6-O-(1-CARBOXYETHYLIDENE)-BETA-
D-GLUCOSE		A1CAP0.77
CEG4,6-O-(1-CARBOXYETHYLIDENE)-BETA-
D-GLUCOSE		A1J0N0.77
AD0DIGALACTURONIC ACIDA,B2UVF0.94
2GL4-O-ACETYL-2,6-DIDEOXY-ALPHA-D-
GALACTO-HEXOPYRANOSE		A,B1EKH0.71
2GL4-O-ACETYL-2,6-DIDEOXY-ALPHA-D-
GALACTO-HEXOPYRANOSE		A,B1EKI0.71
BEMbeta-D-mannuronic acidA2ZAA0.89
BEMbeta-D-mannuronic acidA2ZAC0.89
BEMbeta-D-mannuronic acidA2ZAB0.89
BEMbeta-D-mannuronic acidA1Y3N0.89
BEMbeta-D-mannuronic acidA1Y3P0.89
BEMbeta-D-mannuronic acidA,B1J1N0.89
CDGMETHYL 4,6-O-[(1R)-1-CARBOXYETHYLIDENE]-
BETA-D-GALACTOPYRANOSIDE		A,B,C,D,E1GYK0.79
CKP(2R,3R,4S,5R)-2,3,4-TRIHYDROXY-
5-[(PHOSPHONATOOXY)METHYL]TETRAHYDROFURAN-
2-CARBOXYLIC ACID		A,B,C,D,E,F,
G,H,I,J,K,L		2DCN0.75
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NST0.89
ADAALPHA-D-GALACTOPYRANURONIC ACIDA1GXO0.89
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2EWE0.89
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2UVH0.89
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2O040.89
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NTB0.89
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NT90.89
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2NZM0.89
ADAALPHA-D-GALACTOPYRANURONIC ACIDA,B2Z8S0.89
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2UVJ0.89
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2O0V0.89
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NSP0.89
ADAALPHA-D-GALACTOPYRANURONIC ACIDA,B3B8Y0.89
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NT60.89
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2O170.89
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NTP0.89
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2O1D0.89
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NTQ0.89
46M(4AR,6R,7S,8R,8AS)-HEXAHYDRO-6,7,8-
TRIHYDROXY-2-METHYLPYRANO[3,2-D][1,3]DIOXINE-
2-CARBOXYLIC ACID		A1X1I0.77
AOSD-ALLOSEA,B,C,D2I570.72
DG04-O-alpha-D-galactopyranuronosyl-
alpha-D-galactopyranuronic acid		A3DYB0.94
DGDDIGALACTOSYL DIACYL GLYCEROL (DGDG)A2C9E0.73
DGDDIGALACTOSYL DIACYL GLYCEROL (DGDG)M,N,O1PPR0.73
DGDDIGALACTOSYL DIACYL GLYCEROL (DGDG)A,B,C,D,E,F,
H,I,J,K,L,M,
O,T,V,X,Z		3BZ20.73
DGDDIGALACTOSYL DIACYL GLYCEROL (DGDG)A,B,C2BHW0.73
DGDDIGALACTOSYL DIACYL GLYCEROL (DGDG)A,B,C,D,E,F,
G,H,I,J		1RWT0.73
DGDDIGALACTOSYL DIACYL GLYCEROL (DGDG)A,B,C,D,E,F,
H,I,J,K,M,O,
T,V,Z		3BZ10.73
DGDDIGALACTOSYL DIACYL GLYCEROL (DGDG)A,B,C,D,F,H,
K,L,T,V,Z		3A0H0.73
DGDDIGALACTOSYL DIACYL GLYCEROL (DGDG)A,B,C,D,F,H,
I,K,L,M,T,V,X		2AXT0.73
DGDDIGALACTOSYL DIACYL GLYCEROL (DGDG)A,B,C,D,E,H,
J,K,L,T,V,Z		3A0B0.73
B2GGALACTOBIOSEA,B2CCR0.7
B2GGALACTOBIOSEA,B2J740.7
B2GGALACTOBIOSEA,B1UR40.7
149D-GALCTOPYRANOSYL-1-ONA,B,C,D1JZ50.82
149D-GALCTOPYRANOSYL-1-ONA,B,C,D3CZJ0.82
DEL4-DEOXYLACTOSEA1GA80.7
CBICELLOBIOSEA,B1K720.7
CBICELLOBIOSEA1Z3T0.7
CBICELLOBIOSEA,B,C,D2OVW0.7
CBICELLOBIOSEA,B1TVP0.7
CBICELLOBIOSEA2A3H0.7
CBICELLOBIOSEA1OA70.7
CBICELLOBIOSEA2B1R0.7
CBICELLOBIOSEA,B,C,D2RFY0.7
CBICELLOBIOSEA3ENG0.7
CBICELLOBIOSEA2OLH0.7
CBICELLOBIOSEA,B,C,D2RG00.7
CBICELLOBIOSEA2O7I0.7
CBICELLOBIOSEA2DWI0.7
CBICELLOBIOSEA1G0C0.7
CBICELLOBIOSEA1QI00.7
2OS3-N-OCTANOYLSUCROSEA,B1T3I0.74
46D(4AR,6R,7S,8R,8AR)-8-((5R,6R)-3-
CARBOXY-TETRAHYDRO-4,5,6-TRIHYDROXY-
2H-PYRAN-2-YLOXY)-HEXAHYDRO-6,7-
DIHYDROXY-2-METHYLPYRANO[3,2-D][1,3]DIOXINE-
2-CARBOXYLIC ACID)		A1X1J0.88