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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03034358

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
THOREDUCED THREONINEA1SOC0.87
THOREDUCED THREONINEA2SOC0.87
YHO(1S,2S,3R,4R)-4-aminocyclopentane-
1,2,3-triol
A3DX10.81
YTB(1R,2R,3S,4R,5R)-5-aminocyclopentane-
1,2,3,4-tetrol
A3DX30.79
AOL(1R,2R,3S,4S,5R)-5-AMINOCYCLOPENTANE-
1,2,3,4-TETROL
A2F7Q0.79
SEL2-AMINO-1,3-PROPANEDIOLD1D5X0.79
TSI(2S,3R)-1-AMINO-2-METHYLBUTANE-
2,3-DIOL
A1E9W0.74
TSI(2S,3R)-1-AMINO-2-METHYLBUTANE-
2,3-DIOL
B1OLN0.74
TSI(2S,3R)-1-AMINO-2-METHYLBUTANE-
2,3-DIOL
C2JQ70.74
GPEL-ALPHA-GLYCEROPHOSPHORYLETHANOLAMINEA1A8B0.73
IMRIMINORIBITOLA,B,C1I800.73
1AB1,4-DIDEOXY-1,4-IMINO-D-ARABINITOLA2G9Q0.73
AZFAZAFAGOMINEA,B2J7H0.72
GOO(1R,2R,3R,4S,5R)-4-amino-5-methoxycyclopentane-
1,2,3-triol
A3DX40.72
PA2PAROMOMYCIN (RING 2)B1O9M0.71
PA2PAROMOMYCIN (RING 2)A1PBR0.71
OXZTETRAHYDROOXAZINEA,B1W3J0.71
OXZTETRAHYDROOXAZINEA1W3K0.71
OXZTETRAHYDROOXAZINEA1W3L0.71
VOLL-VALINOLA,B1M240.71
HSEL-HOMOSERINEA2VDJ0.7
HSEL-HOMOSERINEA,B,C,D1EBU0.7
HSEL-HOMOSERINEA,C1J9N0.7
HSEL-HOMOSERINEA1PQP0.7
HSEL-HOMOSERINEC1H720.7
HSEL-HOMOSERINEE,F3DKS0.7
B3S(3R)-3-AMINO-4-HYDROXYBUTANOIC ACIDA2OXK0.7
B3S(3R)-3-AMINO-4-HYDROXYBUTANOIC ACIDA,B,C2OXJ0.7
B3S(3R)-3-AMINO-4-HYDROXYBUTANOIC ACIDA1J8N0.7