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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01394497

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
PVHHISTIDINE-METHYL-ESTERB,D,F1IBV0.72
PVHHISTIDINE-METHYL-ESTERB,D,F1IBW0.72
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
T2P8Z0.72
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
T2P8Y0.72
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,B,C,D,E,F2ZIT0.72
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,C,E1ZM30.72
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A1U2R0.72
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,B,C,D,E,F1ZM90.72
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,B,C,D,E,F3B780.72
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,B,C,D,E,F3B8H0.72
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
T2P8X0.72
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,B,C,D,E,F3B820.72
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,B,C,D,E,F1ZM40.72
DDE{3-[4-(2-AMINO-2-CARBOXY-ETHYL)-
1H-IMIDAZOL-2-YL]-1-CARBAMOYL-PROPYL}-
TRIMETHYL-AMMONIUM
A,C,E1ZM20.72
NEPN1-PHOSPHONOHISTIDINEA,B3FDZ0.7
NEPN1-PHOSPHONOHISTIDINEA,B,D,E2NU60.7
NEPN1-PHOSPHONOHISTIDINEA1E580.7
NEPN1-PHOSPHONOHISTIDINEA,B1TIP0.7
NEPN1-PHOSPHONOHISTIDINEA,B2QE60.7
NEPN1-PHOSPHONOHISTIDINEA,B,C1WVQ0.7
NEPN1-PHOSPHONOHISTIDINEA,B2HHJ0.7
NEPN1-PHOSPHONOHISTIDINEA,B,D,E,F,G,
H,I
2NU90.7
NEPN1-PHOSPHONOHISTIDINEA,B1EUD0.7
NEPN1-PHOSPHONOHISTIDINEA,D1SCU0.7
NEPN1-PHOSPHONOHISTIDINEA,B2FPP0.7
NEPN1-PHOSPHONOHISTIDINEA,B2HWG0.7
NEPN1-PHOSPHONOHISTIDINEA,B1VSQ0.7
NEPN1-PHOSPHONOHISTIDINEA,B2FPI0.7
NEPN1-PHOSPHONOHISTIDINEA1QWO0.7
NEPN1-PHOSPHONOHISTIDINEA,B,D,E2SCU0.7
NEPN1-PHOSPHONOHISTIDINEA,B2FP40.7
HS83-(1-sulfo-1H-imidazol-3-ium-4-
yl)-L-alanine
A,B3ETS0.77
HS83-(1-sulfo-1H-imidazol-3-ium-4-
yl)-L-alanine
A,B3ETT0.77
DHID-HISTIDINEP1MCB0.75
DHID-HISTIDINEA2EZ70.75
DHID-HISTIDINEP1MCN0.75
DHID-HISTIDINEA,D1CZQ0.75
DHID-HISTIDINEI1ER80.75
DHID-HISTIDINEP1MCL0.75
DHID-HISTIDINEA,B,C,D3BOG0.75
DHID-HISTIDINEA,L1ZEA0.75
HIPND1-PHOSPHONOHISTIDINEA,B,C,D,E,F2VME0.73
HIPND1-PHOSPHONOHISTIDINEA1NSP0.73
HIPND1-PHOSPHONOHISTIDINEA,B,C1NSQ0.73
HIPND1-PHOSPHONOHISTIDINEA1PFH0.73
HIPND1-PHOSPHONOHISTIDINEA1JEM0.73
PSH1-thiophosphono-L-histidineA2R7C0.71
MH11-methyl-L-histidineA,B3G880.71
MH11-methyl-L-histidineA,B3G890.71
MH11-methyl-L-histidineA,B,C,D,E,F3G8A0.71
BDHL-BETA-ASPARTYLHISTIDINEA,B1YBQ0.72
HIC4-METHYL-HISTIDINEA2Q970.71
HIC4-METHYL-HISTIDINEA1QZ60.71
HIC4-METHYL-HISTIDINEA3CHW0.71
HIC4-METHYL-HISTIDINEA,B2GWK0.71
HIC4-METHYL-HISTIDINEA,B,D,E1MDU0.71
HIC4-METHYL-HISTIDINEA2ASO0.71
HIC4-METHYL-HISTIDINEA,B2D1K0.71
HIC4-METHYL-HISTIDINEA,S1C0F0.71
HIC4-METHYL-HISTIDINEA,D1ATN0.71
HIC4-METHYL-HISTIDINEA,B2A420.71
HIC4-METHYL-HISTIDINEA,P2BTF0.71
HIC4-METHYL-HISTIDINEA,B1LOT0.71
HIC4-METHYL-HISTIDINEA1NWK0.71
HIC4-METHYL-HISTIDINEA,S1C0G0.71
HIC4-METHYL-HISTIDINEA,S1EQY0.71
HIC4-METHYL-HISTIDINEA2PAV0.71
HIC4-METHYL-HISTIDINEA2Q0U0.71
HIC4-METHYL-HISTIDINEA,B2HMP0.71
HIC4-METHYL-HISTIDINEA2PBD0.71
HIC4-METHYL-HISTIDINEA,S1DEJ0.71
HIC4-METHYL-HISTIDINEA,S1ESV0.71
HIC4-METHYL-HISTIDINEA1J6Z0.71
HIC4-METHYL-HISTIDINEA1WUA0.71
HIC4-METHYL-HISTIDINEA,B1YXQ0.71
HIC4-METHYL-HISTIDINEA1S220.71
HIC4-METHYL-HISTIDINEA,B,D,E2A400.71
HIC4-METHYL-HISTIDINEA1QZ50.71
HIC4-METHYL-HISTIDINEA2ZWH0.71
HIC4-METHYL-HISTIDINEA,B2A410.71
HIC4-METHYL-HISTIDINEB1MA90.71
HIC4-METHYL-HISTIDINEA,G3CI50.71
HIC4-METHYL-HISTIDINEA1Y640.71
HIC4-METHYL-HISTIDINEA,P1HLU0.71
HIC4-METHYL-HISTIDINEA,B2A3Z0.71
HIC4-METHYL-HISTIDINEA2FXU0.71
HIC4-METHYL-HISTIDINEA,G3CIP0.71
HIC4-METHYL-HISTIDINEA2GWJ0.71
HIC4-METHYL-HISTIDINEA,B2VCP0.71
MHSN1-METHYLATED HISTIDINEA,B,C,D,E,F1HBO0.71
MHSN1-METHYLATED HISTIDINEA,C,D,F1MRO0.71
MHSN1-METHYLATED HISTIDINEA,C,D,F1E6Y0.71
MHSN1-METHYLATED HISTIDINEA,B,C,D,E,F1HBM0.71
MHSN1-METHYLATED HISTIDINEA,B,C,D,E,F1HBN0.71
MHSN1-METHYLATED HISTIDINEA,B,C,D,E,F1HBU0.71