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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02366355

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
DSEN-METHYL-D-SERINEC1CWH0.72
2AO(2S)-2-AMINOHEXAN-1-OLA,B,C2AVM0.71
2AO(2S)-2-AMINOHEXAN-1-OLA,I2O400.71
2AO(2S)-2-AMINOHEXAN-1-OLA,B,C2AOD0.71
2AO(2S)-2-AMINOHEXAN-1-OLA,B,C2AVQ0.71
2AO(2S)-2-AMINOHEXAN-1-OLA,B,C2AOC0.71
VOLL-VALINOLA,B1M240.77
MAAN-METHYLALANINEA,B1A7Z0.7
MAAN-METHYLALANINEA,B2VSL0.7
MAAN-METHYLALANINEC1CWI0.7
MAAN-METHYLALANINEC,F,G,H3DW80.7
MAAN-METHYLALANINEA,B,C,D,E,F,
G,H
2NYL0.7
MAAN-METHYLALANINED1D5X0.7
MAAN-METHYLALANINEC1PYW0.7
MAAN-METHYLALANINEA,B,C,D,E,F,
G,H
2NYM0.7
MAAN-METHYLALANINEC,I2IE30.7
MAAN-METHYLALANINEC,F,X,Y2NPP0.7
CHTCHOLINE IONA,B2REG0.74
CHTCHOLINE IONA,B1HCX0.74
CHTCHOLINE IONA2FY30.74
CHTCHOLINE IONA,B1H8G0.74
CHTCHOLINE IONC2VYU0.74
CHTCHOLINE IONA,B,C,D,E,F1GVM0.74
CHTCHOLINE IONA1P0M0.74
CHTCHOLINE IONA2V040.74
CHTCHOLINE IONA1OBA0.74
CHTCHOLINE IONA,B2HA30.74
CHTCHOLINE IONA,B,C,D3C5I0.74
CHTCHOLINE IONA2V050.74
THOREDUCED THREONINEA1SOC0.75
THOREDUCED THREONINEA2SOC0.75
SEL2-AMINO-1,3-PROPANEDIOLD1D5X0.76
FOP2-HYDROXY-PROPYL-AMMONIUMA1ID80.7