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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00010120

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
AOA(AMINOOXY)ACETIC ACIDA1J040.76
AOA(AMINOOXY)ACETIC ACIDA1H0C0.76
AOA(AMINOOXY)ACETIC ACIDB,D,F,H1WYV0.76
GOAGLYCOLIC ACIDC,D2HG50.88
GOAGLYCOLIC ACIDC,D2H8P0.88
GOAGLYCOLIC ACIDA,B,C,D,E,F,
G,H		1QKI0.88
GOAGLYCOLIC ACIDC,D2HFE0.88
GOAGLYCOLIC ACIDA,B,C,D2O990.88
GOAGLYCOLIC ACIDA,B,C,D1RYI0.88
LACLACTIC ACIDA2FLT0.77
LACLACTIC ACIDA2IMP0.77
LACLACTIC ACIDA1C0Q0.77
LACLACTIC ACIDE,I,P1P110.77
LACLACTIC ACIDA,B2NLI0.77
LACLACTIC ACIDA,B,C,D2PI10.77
LACLACTIC ACIDA1C0R0.77
LACLACTIC ACIDA1UHD0.77
LACLACTIC ACIDC,D1AXD0.77
LACLACTIC ACIDA1QH90.77
LACLACTIC ACIDA2P1E0.77
LACLACTIC ACIDA1K870.77
LACLACTIC ACIDE,I1P120.77
LACLACTIC ACIDA1W3Q0.77
LACLACTIC ACIDA1C0K0.77
LACLACTIC ACIDA,B2FN70.77
LACLACTIC ACIDA1TJ10.77
LACLACTIC ACIDA1TJ00.77
MXE2-METHOXYETHANOLA1PJX0.7
MXE2-METHOXYETHANOLA,B2CB80.7
OEGC2R000.8
2OP(2S)-2-HYDROXYPROPANOIC ACIDA,B,C,D2VK80.77
2OP(2S)-2-HYDROXYPROPANOIC ACID0,1,3,4,9,A,
B,C,H,J,K,L,
M,N,O,Q,R,S,
T,U,Y,Z		1VQ70.77
2OP(2S)-2-HYDROXYPROPANOIC ACID0,1,3,4,9,A,
B,C,H,J,K,L,
M,N,O,Q,R,S,
T,U,Y,Z		1VQ40.77
2OP(2S)-2-HYDROXYPROPANOIC ACIDA,C,E2VOJ0.77
2OP(2S)-2-HYDROXYPROPANOIC ACID0,1,2,3,4,9,
A,B,C,H,J,K,
L,M,N,O,Q,R,
S,T,U,Y,Z		1VQ50.77
2OP(2S)-2-HYDROXYPROPANOIC ACIDA1W9N0.77