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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03089418

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
AMUBETA-N-ACETYLMURAMIC ACIDA,B,C,D2APH0.73
AMUBETA-N-ACETYLMURAMIC ACIDA,P1TWQ0.73
AMUBETA-N-ACETYLMURAMIC ACIDA1D0K0.73
AMUBETA-N-ACETYLMURAMIC ACIDS9LYZ0.73
AMUBETA-N-ACETYLMURAMIC ACIDE,S148L0.73
AMUBETA-N-ACETYLMURAMIC ACIDD,K3CYQ0.73
AMUBETA-N-ACETYLMURAMIC ACIDU2AIZ0.73
AMN9-DEOXY-9-AMINO-2-O-METHYL-5-N-
ACETYL-ALPHA-D-NEURAMINIC ACID
A,B,C,D,E,F1HGJ0.72
ASG2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-
4-SULFATE
A1RWG0.7
ASG2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-
4-SULFATE
A1HM20.7
ASG2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-
4-SULFATE
A1RWF0.7
ASG2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-
4-SULFATE
A1OFL0.7
ASG2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-
4-SULFATE
A3C9E0.7
ASG2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-
4-SULFATE
A2C4S0.7
ASG2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-
4-SULFATE
A1C4S0.7
ASG2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-
4-SULFATE
A1OFM0.7
ASG2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-
4-SULFATE
A1OJO0.7
ASG2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-
4-SULFATE
A1HMW0.7
ASG2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-
4-SULFATE
A1DQO0.7
ASG2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-
4-SULFATE
A1HMU0.7
ASG2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-
4-SULFATE
A1RWH0.7
7GPETHYL-N-(BETA-D-GLUCOPYRANOSYL)OXAMATEA2F3S0.73
AMVMETHYL 2-(ACETYLAMINO)-3-O-[(1R)-
1-CARBOXYETHYL]-2-DEOXY-BETA-D-
GLUCOPYRANOSIDE
A2J8G0.72
AMVMETHYL 2-(ACETYLAMINO)-3-O-[(1R)-
1-CARBOXYETHYL]-2-DEOXY-BETA-D-
GLUCOPYRANOSIDE
A2J8F0.72
4GPN-(BETA-D-GLUCOPYRANOSYL)OXAMIC ACIDA2F3P0.74
DT62,4-BIS(ACETYLAMINO)-1,5-ANHYDRO-
2,4-DIDEOXY-D-GLUCITOL
A,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R
2HIL0.72
DT62,4-BIS(ACETYLAMINO)-1,5-ANHYDRO-
2,4-DIDEOXY-D-GLUCITOL
A2HI20.72
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B,C,D2E510.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA1D0H0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA1JOT0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA1LLP0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEX,Y2EAL0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B1LU20.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B,C,E,F2J3F0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA1LU10.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSED,E,F,G,H,I,
J,K,L,M
3EFX0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA2VMC0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B2W7Y0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA1FNZ0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B,C,D2W1U0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEF2JHI0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,C,E,G1M260.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B,C,D2DTY0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B2J1U0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA2CCV0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA2A2D0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA2AYS0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B,C,D2ZUT0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA1KYJ0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B2VNG0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B2Z480.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSE1,2,31BCH0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA2K330.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA2IXB0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B1ULF0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B1JLX0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA1AX00.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA3CA30.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B,C,D1WMZ0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA3CA60.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSED,E,G,H1LTI0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B,C,D2E7T0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEN,O,P,Q,R,S,
T,U,V,W
2O2L0.74
BGNN-BUTANOYL-2-AMINO-2-DEOXY-GLUCOPYRANOSIDEA,B,C,D1NWG0.76
5AX2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY-
D-GLUCITOL
A2JCQ0.74
5AX2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY-
D-GLUCITOL
A,B2IH90.74
5AX2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY-
D-GLUCITOL
A,B,C,D,E,F2J2P0.74
5AX2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY-
D-GLUCITOL
A3DIV0.74
233[5-(3,4,5-TRIHYDROXY-6-HYDROXYMETHYL-
TETRAHYDRO-PYRAN-2-YLCARBAMOYL)-
PENTYL]-CARBAMIC ACID METHYL ESTER
D,E,F,G,H1MD20.76
CR11-DEOXY-1-METHOXYCARBAMIDO-BETA-
D-GLUCOPYRANOSE
A1FU70.71
6GPMETHYL-N-(BETA-D-GLUCOPYRANOSYL)OXAMATEA2F3Q0.74
C6LN-hexanoyl-L-homoserineA3DHA0.78
C6LN-hexanoyl-L-homoserineA3DHB0.78
CR61-DEOXY-1-ACETYLAMINO-BETA-D-GLUCO-
2-HEPTULOPYRANOSONAMIDE
A1P4H0.72
CR61-DEOXY-1-ACETYLAMINO-BETA-D-GLUCO-
2-HEPTULOPYRANOSONAMIDE
A1FU80.72
CRA1-DEOXY-1-METHOXYCARBAMIDO-BETA-
D-GLUCO-2-HEPTULOPYRANOSONAMIDE
A1FS40.72
CRA1-DEOXY-1-METHOXYCARBAMIDO-BETA-
D-GLUCO-2-HEPTULOPYRANOSONAMIDE
A1B4D0.72
ABW5-[1-(ACETYLAMINO)-3-METHYLBUTYL]-
2,5-ANHYDRO-3,4-DIDEOXY-4-(METHOXYCARBONYL)PENTONIC ACID
A1XOG0.74
DLSDI-ACETYL-LYSINEA,B,C,D,E,F1FVM0.72
ANA4-O-ACETYL-ALPHA-2-OMETHYL-5-N-
ACETYL-ALPHA-D-NEURAMINIC ACID
A,B,C,D,E,F1HGI0.73
BM32-(ACETYLAMINO)-2-DEOXY-ALPHA-D-
MANNOPYRANOSE
A,B,C,D,E,F2J0G0.74
BM32-(ACETYLAMINO)-2-DEOXY-ALPHA-D-
MANNOPYRANOSE
A,B,C2ORJ0.74