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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02384867

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
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		2DCN0.72
3LR3,6-dideoxy-L-arabino-hexonic acidA,B3CXO0.84
CS2D-MANNONIC ACIDA,B,C,D2QJM0.89
CS2D-MANNONIC ACIDA,B3DBN0.89
BDPBETA-D-GALACTOPYRANURONIC ACIDA1N7R0.75
BDPBETA-D-GALACTOPYRANURONIC ACIDA3C9E0.75
BDPBETA-D-GALACTOPYRANURONIC ACIDA1LOH0.75
BDPBETA-D-GALACTOPYRANURONIC ACIDA1CAP0.75
BDPBETA-D-GALACTOPYRANURONIC ACIDA1HM30.75
BDPBETA-D-GALACTOPYRANURONIC ACIDA1HUA0.75
BDPBETA-D-GALACTOPYRANURONIC ACIDA1LXK0.75
BDPBETA-D-GALACTOPYRANURONIC ACIDA,B1GQK0.75
BDPBETA-D-GALACTOPYRANURONIC ACIDA,B1ON80.75
BDPBETA-D-GALACTOPYRANURONIC ACIDP2BVK0.75
BDPBETA-D-GALACTOPYRANURONIC ACIDA2JCR0.75
BDPBETA-D-GALACTOPYRANURONIC ACIDA1LXM0.75
BDPBETA-D-GALACTOPYRANURONIC ACIDA1HMW0.75
BDPBETA-D-GALACTOPYRANURONIC ACIDA3HYA0.75
BDPBETA-D-GALACTOPYRANURONIC ACIDA,B1GQL0.75
BDPBETA-D-GALACTOPYRANURONIC ACIDA1OFM0.75
BDPBETA-D-GALACTOPYRANURONIC ACIDA1N7Q0.75
6PG6-PHOSPHOGLUCONIC ACIDA1PGP0.82
6PG6-PHOSPHOGLUCONIC ACIDA,B1J3R0.82
6PG6-PHOSPHOGLUCONIC ACIDA,B1QY40.82
6PG6-PHOSPHOGLUCONIC ACIDA,B2W8Z0.82
6PG6-PHOSPHOGLUCONIC ACIDA,B3E7F0.82
6PG6-PHOSPHOGLUCONIC ACIDA,B2W900.82
6PG6-PHOSPHOGLUCONIC ACIDA,B1KO80.82
6PG6-PHOSPHOGLUCONIC ACIDA,B2CXR0.82
6PG6-PHOSPHOGLUCONIC ACIDA2IYO0.82
6PG6-PHOSPHOGLUCONIC ACIDA,B1DQR0.82
3MF3-O-METHYLFRUCTOSE IN LINEAR FORMA,B1XYC0.73
1N5(2R,4S)-2,4,7-trihydroxyheptanoic acidA,B3CXO0.83
DG04-O-alpha-D-galactopyranuronosyl-
alpha-D-galactopyranuronic acid		A3DYB0.72
CRB[1R-(1ALPHA,3BETA,4ALPHA,5BETA)]-
5-(PHOSPHONOMETHYL)-1,3,4-TRIHYDROXYCYCLOHEXANE-
1-CARBOXYLIC ACID		A,B1XAI0.72
CRB[1R-(1ALPHA,3BETA,4ALPHA,5BETA)]-
5-(PHOSPHONOMETHYL)-1,3,4-TRIHYDROXYCYCLOHEXANE-
1-CARBOXYLIC ACID		A,B1NVD0.72
CRB[1R-(1ALPHA,3BETA,4ALPHA,5BETA)]-
5-(PHOSPHONOMETHYL)-1,3,4-TRIHYDROXYCYCLOHEXANE-
1-CARBOXYLIC ACID		A1XAG0.72
CRB[1R-(1ALPHA,3BETA,4ALPHA,5BETA)]-
5-(PHOSPHONOMETHYL)-1,3,4-TRIHYDROXYCYCLOHEXANE-
1-CARBOXYLIC ACID		A,B1NR50.72
CRB[1R-(1ALPHA,3BETA,4ALPHA,5BETA)]-
5-(PHOSPHONOMETHYL)-1,3,4-TRIHYDROXYCYCLOHEXANE-
1-CARBOXYLIC ACID		A,B1XAJ0.72
CRB[1R-(1ALPHA,3BETA,4ALPHA,5BETA)]-
5-(PHOSPHONOMETHYL)-1,3,4-TRIHYDROXYCYCLOHEXANE-
1-CARBOXYLIC ACID		A,B1XAL0.72
CRB[1R-(1ALPHA,3BETA,4ALPHA,5BETA)]-
5-(PHOSPHONOMETHYL)-1,3,4-TRIHYDROXYCYCLOHEXANE-
1-CARBOXYLIC ACID		A,B1DQS0.72
CRB[1R-(1ALPHA,3BETA,4ALPHA,5BETA)]-
5-(PHOSPHONOMETHYL)-1,3,4-TRIHYDROXYCYCLOHEXANE-
1-CARBOXYLIC ACID		A,B1NVB0.72
CRB[1R-(1ALPHA,3BETA,4ALPHA,5BETA)]-
5-(PHOSPHONOMETHYL)-1,3,4-TRIHYDROXYCYCLOHEXANE-
1-CARBOXYLIC ACID		A,B,C1NVF0.72
B3H(2S)-2-(BUTYRYLOXY)-3-HYDROXYPROPYL NONANOATEC,D2HFE0.72
B3H(2S)-2-(BUTYRYLOXY)-3-HYDROXYPROPYL NONANOATEC,D2H8P0.72
B3H(2S)-2-(BUTYRYLOXY)-3-HYDROXYPROPYL NONANOATEC,D2HG50.72
AOSD-ALLOSEA,B,C,D2I570.8
BEMbeta-D-mannuronic acidA2ZAA0.75
BEMbeta-D-mannuronic acidA2ZAC0.75
BEMbeta-D-mannuronic acidA2ZAB0.75
BEMbeta-D-mannuronic acidA1Y3N0.75
BEMbeta-D-mannuronic acidA1Y3P0.75
BEMbeta-D-mannuronic acidA,B1J1N0.75
DNOD-mannoseA3BDK0.8
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A,B,C,D1FDJ0.71
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A,B6ALD0.71
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A,B,C,D1ZAI0.71
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A,B,C,D2QDG0.71
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A3ELF0.71
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A4ALD0.71
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A1UMG0.71
1NT(2R,4R,5R,6R,7R)-2,4,5,6,7-PENTAHYDROXY-
2,8-BIS(PHOSPHONOOXY)OCTANOIC ACID		A,B2NXG0.84
1NT(2R,4R,5R,6R,7R)-2,4,5,6,7-PENTAHYDROXY-
2,8-BIS(PHOSPHONOOXY)OCTANOIC ACID		A,B,C,D,E,F,
G,H,I,J,K,L		2NX30.84
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NST0.75
ADAALPHA-D-GALACTOPYRANURONIC ACIDA1GXO0.75
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2EWE0.75
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2UVH0.75
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2O040.75
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NTB0.75
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NT90.75
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2NZM0.75
ADAALPHA-D-GALACTOPYRANURONIC ACIDA,B2Z8S0.75
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2UVJ0.75
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2O0V0.75
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NSP0.75
ADAALPHA-D-GALACTOPYRANURONIC ACIDA,B3B8Y0.75
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NT60.75
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2O170.75
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NTP0.75
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2O1D0.75
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NTQ0.75
149D-GALCTOPYRANOSYL-1-ONA,B,C,D1JZ50.81
149D-GALCTOPYRANOSYL-1-ONA,B,C,D3CZJ0.81
AD0DIGALACTURONIC ACIDA,B2UVF0.72
DDR(2S)-3-hydroxypropane-1,2-diyl didecanoateA2Z9Y0.7
DDR(2S)-3-hydroxypropane-1,2-diyl didecanoateA2Z9Z0.7
1EM(1S)-2-HYDROXY-1-[(NONANOYLOXY)METHYL]ETHYL MYRISTATEC2IH10.7
1EM(1S)-2-HYDROXY-1-[(NONANOYLOXY)METHYL]ETHYL MYRISTATEC2IH30.7
1EM(1S)-2-HYDROXY-1-[(NONANOYLOXY)METHYL]ETHYL MYRISTATEA,C2P7T0.7