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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00013248

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
3GCGAMMA-GLUTAMYLCYSTEINEA,B2BU30.84
3GCGAMMA-GLUTAMYLCYSTEINEA,B1M0W0.84
GGAD-GAMMA-GLUTAMYL-N-{[(R)-{4-[(4-
AMINOBUTYL)AMINO]BUTYL}(PHOSPHONOOXY)PHOSPHORYL]METHYL}-
D-ALANINAMIDE
A,B2IOA0.71
DPRD-PROLINEP1MCB0.71
DPRD-PROLINEA,B,C,H,K,L2R5B0.71
DPRD-PROLINEA2KDQ0.71
DPRD-PROLINEP1MCS0.71
DPRD-PROLINEA,B2AXI0.71
DPRD-PROLINEA1JY90.71
DPRD-PROLINEA2JUE0.71
DPRD-PROLINEP1MCK0.71
DPRD-PROLINEP1MCR0.71
DPRD-PROLINEA2D550.71
DPRD-PROLINEA1T8J0.71
DPRD-PROLINEA,B2EJ60.71
DPRD-PROLINEP1MCE0.71
DPRD-PROLINEP1MCI0.71
DPRD-PROLINEA,B1SNE0.71
DPRD-PROLINEA,B,C1QFI0.71
DPRD-PROLINEA,P1MCD0.71
DPRD-PROLINEA1ICL0.71
DPRD-PROLINEP1MCQ0.71
DPRD-PROLINEG,M,P,S2I5Y0.71
DPRD-PROLINEA,B,C,D3BOG0.71
DPRD-PROLINEA,L1ZEA0.71
DPRD-PROLINEA,B173D0.71
DPRD-PROLINEA,P1MCJ0.71
DPRD-PROLINEA,B,C1A7Y0.71
DPRD-PROLINEA1IC90.71
DPRD-PROLINEA,B1JY60.71
DPRD-PROLINEA209D0.71
DPRD-PROLINEA1BFW0.71
DPRD-PROLINEA,B1O6I0.71
DPRD-PROLINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R,
S,T,U,V,W,X
1UNJ0.71
DPRD-PROLINEA,B,C,D2R3C0.71
DPRD-PROLINEA,B,C,D1I3W0.71
DPRD-PROLINEA316D0.71
DPRD-PROLINEA,B,C,D1SN90.71
DPRD-PROLINEA,B,C,H,K,L2R5D0.71
DPRD-PROLINEA,B2Q330.71
DPRD-PROLINEG,M,P,S2I600.71
DPRD-PROLINEA,B1JY40.71
DPRD-PROLINEP1MCF0.71
DPRD-PROLINEA,B,C,D,E,F1UNM0.71
DPRD-PROLINEA1ICO0.71
DPRD-PROLINEA,B1XOF0.71
DPRD-PROLINEP1MCC0.71
DPRD-PROLINEA,B,C,D1SNA0.71
AORN~2~-ACETYL-L-ORNITHINEA1ZQ60.81
AHE2-AMINO-4-[1-CARBOXYMETHYL-CARBAMOYL)-
2-HYDROXYMETHYLSULFANYL-ETHYLCARBAMOYL]-
BUTYRIC ACID
A3BHM0.76
AHE2-AMINO-4-[1-CARBOXYMETHYL-CARBAMOYL)-
2-HYDROXYMETHYLSULFANYL-ETHYLCARBAMOYL]-
BUTYRIC ACID
A,B1MC50.76
DI63-[(4S)-2,5-DIOXOIMIDAZOLIDIN-4-
YL]PROPANOIC ACID
A2Q090.74
DLSDI-ACETYL-LYSINEA,B,C,D,E,F1FVM0.76
GCGBIS(GAMMA-GLUTAMYL-CYSTEINYL-GLYCINYL)SPERMIDINEA4GRT0.72
GCGBIS(GAMMA-GLUTAMYL-CYSTEINYL-GLYCINYL)SPERMIDINEA,B1BZL0.72
193(2S)-4-(BETA-ALANYLAMINO)-2-AMINOBUTANOIC ACIDA1XY50.71
AN0N-ACETYL-L-NORVALINEC,D,E,X,Y,Z2G7M0.75
AN0N-ACETYL-L-NORVALINEA1ZQ80.75
FHON^5^-FORMYL-N^5^-HYDROXY-L-ORNITHINEA,B,C2W6T0.72
FHON^5^-FORMYL-N^5^-HYDROXY-L-ORNITHINEA,B,C2W160.72
FHON^5^-FORMYL-N^5^-HYDROXY-L-ORNITHINEA,B,C2W760.72
FHON^5^-FORMYL-N^5^-HYDROXY-L-ORNITHINEA,B,C2W780.72
FHON^5^-FORMYL-N^5^-HYDROXY-L-ORNITHINEA,B,C2W770.72
FH7N^5^-formyl-N^5^-hydroxy-D-ornithineA,B,C2W6T0.72
FH7N^5^-formyl-N^5^-hydroxy-D-ornithineA,B,C2W780.72
FH7N^5^-formyl-N^5^-hydroxy-D-ornithineA,B,C2W770.72
CIRCITRULLINEA,B,C,D1J210.74
CIRCITRULLINEB1KOD0.74
CIRCITRULLINEA,B,C3B3I0.74
CIRCITRULLINEC3DTX0.74
CIRCITRULLINEA2C6Z0.74
CIRCITRULLINEA,C,E,F2W650.74
CIRCITRULLINEA,B2JAI0.74
CIRCITRULLINEP3FT20.74
CIRCITRULLINEA,B,C,D1J1Z0.74
CIRCITRULLINEA,B1LXY0.74
CIRCITRULLINEF,H1OL10.74
CIRCITRULLINEA1KP30.74
CIRCITRULLINEA2NZ20.74
CIRCITRULLINEA1H700.74
CIRCITRULLINEA1K970.74
CIRCITRULLINEC3B6S0.74
52A(2R,4R)-4-aminopyrrolidine-2,4-
dicarboxylic acid
A,B2E4Y0.72
ALYN(6)-ACETYLLYSINEA,B2B4D0.72
ALYN(6)-ACETYLLYSINEA,B2OD90.72
ALYN(6)-ACETYLLYSINEA,B,C,P,Q2DVR0.72
ALYN(6)-ACETYLLYSINEA,B,C,P,Q2DVS0.72
ALYN(6)-ACETYLLYSINEA,B,C,P,Q2DVQ0.72
ALYN(6)-ACETYLLYSINEA,B,C,D2OT70.72
ALYN(6)-ACETYLLYSINEA,B2B5G0.72
ALYN(6)-ACETYLLYSINEA2GIV0.72
ALYN(6)-ACETYLLYSINEB2RNY0.72
ALYN(6)-ACETYLLYSINEA1JSP0.72
ALYN(6)-ACETYLLYSINEA,B,I,L2V5W0.72
ALYN(6)-ACETYLLYSINEA,D3D4B0.72
ALYN(6)-ACETYLLYSINEA,B,C,D2OQ60.72
ALYN(6)-ACETYLLYSINEA,B2R0Y0.72
ALYN(6)-ACETYLLYSINEA3CZ70.72
ALYN(6)-ACETYLLYSINEA1JM40.72
ALYN(6)-ACETYLLYSINEA,B2H4H0.72
ALYN(6)-ACETYLLYSINEA,B2J6V0.72
ALYN(6)-ACETYLLYSINEA,B2R100.72
ALYN(6)-ACETYLLYSINEA,B1YC50.72
ALYN(6)-ACETYLLYSINEA,B,C,D2OX00.72
ALYN(6)-ACETYLLYSINEA,B2H2G0.72
ALYN(6)-ACETYLLYSINEA,D2H4F0.72
ALYN(6)-ACETYLLYSINEA2OU20.72
ALYN(6)-ACETYLLYSINEA,B1S5P0.72
ALYN(6)-ACETYLLYSINEB2RNW0.72
ALYN(6)-ACETYLLYSINEA3D350.72
ALYN(6)-ACETYLLYSINEA,B2OD20.72
ALYN(6)-ACETYLLYSINEA2ZFN0.72
ALYN(6)-ACETYLLYSINEC,D2C1J0.72
ALYN(6)-ACETYLLYSINEA,B2QQG0.72
ALYN(6)-ACETYLLYSINEB2RNX0.72
ALYN(6)-ACETYLLYSINEA,B1MA30.72
ALYN(6)-ACETYLLYSINEA,B2H2H0.72
ALYN(6)-ACETYLLYSINEA2I2Z0.72
ALYN(6)-ACETYLLYSINEA,B2OD70.72
ALYN(6)-ACETYLLYSINEP1E6I0.72
ALYN(6)-ACETYLLYSINEA,B1SZC0.72
ALYN(6)-ACETYLLYSINEA,B,C,D,I,J,
K,L
3EWF0.72
ALYN(6)-ACETYLLYSINEA,B2H2D0.72
ALYN(6)-ACETYLLYSINEA,B1Q1A0.72
ALYN(6)-ACETYLLYSINEA,B1SZD0.72
ALYN(6)-ACETYLLYSINEQ,R2E3K0.72
ALYN(6)-ACETYLLYSINEA2OZU0.72
ALYN(6)-ACETYLLYSINEA,B2QQF0.72
ALYN(6)-ACETYLLYSINEA,B,C2R0V0.72
GDSOXIDIZED GLUTATHIONE DISULFIDEA,B1YKC0.76
GDSOXIDIZED GLUTATHIONE DISULFIDEA2GRT0.76
GDSOXIDIZED GLUTATHIONE DISULFIDEA3GX00.76
GLHN-5-CYCLOHEXYL-N-5-[(CYCLOHEXYLAMINO)CARBONYL]GLUTAMINEA,B,C,D,E,F,
G,H,I,J
2DB40.73
GLHN-5-CYCLOHEXYL-N-5-[(CYCLOHEXYLAMINO)CARBONYL]GLUTAMINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z
2DYS0.73
GLHN-5-CYCLOHEXYL-N-5-[(CYCLOHEXYLAMINO)CARBONYL]GLUTAMINEA,B,C,D,E,F1E790.73
AHON-ACETYL-N-HYDROXY-L-ORNITHINEA,B1BY50.76
AHON-ACETYL-N-HYDROXY-L-ORNITHINEA,B,C2W6U0.76
AAGN-ALPHA-L-ACETYL-ARGININEA1DRY0.73
DGND-GLUTAMINEA,D2Q3I0.73
DGND-GLUTAMINEA,L1ZEA0.73
DGND-GLUTAMINEA,B2FCM0.73
DGND-GLUTAMINEA1BFW0.73
DGND-GLUTAMINEE1EPR0.73
DGND-GLUTAMINEA2JX40.73
DGND-GLUTAMINEA,B,C,D2R3C0.73
DGND-GLUTAMINEA,B,C,H,K,L2R5D0.73
DGND-GLUTAMINEA,B2Q330.73
DGND-GLUTAMINEA,B,C,H,K,L2R5B0.73
DGND-GLUTAMINEA,B,C1YJ10.73
DGND-GLUTAMINEA1B740.73