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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03034511

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
ASLASPARTIC ACID-4-CARBOXYETHYL ESTERA,B2NO50.83
BHDBETA-HYDROXYASPARTIC ACIDA1WHE0.86
BHDBETA-HYDROXYASPARTIC ACIDA2DDE0.86
BHDBETA-HYDROXYASPARTIC ACIDC,L1XKA0.86
BHDBETA-HYDROXYASPARTIC ACIDA1ERM0.86
BHDBETA-HYDROXYASPARTIC ACIDL,P1AUT0.86
BHDBETA-HYDROXYASPARTIC ACIDA1WHF0.86
BHDBETA-HYDROXYASPARTIC ACIDL1PFX0.86
BHDBETA-HYDROXYASPARTIC ACIDA,B,C,D1XKB0.86
2AS(2S,3S)-3-amino-2-methyl-4-oxobutanoic acidA,B,C,D,E,F,
G,H,I,J,K,L
1W3M0.71
ALOALLO-THREONINEI,P1HDT0.85
ALOALLO-THREONINEA2JUU0.85
ALOALLO-THREONINEA2VMX0.85
AEITHREONINE-ASPARTIC ESTERA,B,C,D4ECA0.81
CTH4-CHLOROTHREONINEA,B1A7Z0.72
CANCANALINEA,B,C2CAN0.75
D11D-PHOSPHOTHREONINEA,B2ITK0.76
DASD-ASPARTIC ACIDA1BFW0.71
DASD-ASPARTIC ACIDA,B,C,H,K,L2R5D0.71
DASD-ASPARTIC ACIDA1KS70.71
DASD-ASPARTIC ACIDA1C4B0.71
DASD-ASPARTIC ACIDA,B,C,D3BOG0.71
DASD-ASPARTIC ACIDA,L1ZEA0.71
DASD-ASPARTIC ACIDA,B,C,D1HG10.71
DASD-ASPARTIC ACIDA,B,C,H,K,L2R5B0.71
DASD-ASPARTIC ACIDA,B2Q330.71
DASD-ASPARTIC ACIDE1AN10.71
3MD2S,3S-3-METHYLASPARTIC ACIDA,B1KKR0.71
3MD2S,3S-3-METHYLASPARTIC ACIDA,B,C,D1I9C0.71
B3S(3R)-3-AMINO-4-HYDROXYBUTANOIC ACIDA2OXK0.76
B3S(3R)-3-AMINO-4-HYDROXYBUTANOIC ACIDA,B,C2OXJ0.76
B3S(3R)-3-AMINO-4-HYDROXYBUTANOIC ACIDA1J8N0.76
DSEN-METHYL-D-SERINEC1CWH0.71
DSND-SERINEA1XVN0.72
DSND-SERINEA2IGZ0.72
DSND-SERINEA,B,C,D2R3C0.72
DSND-SERINEA1BFW0.72
DSND-SERINEA,B,C2W160.72
DSND-SERINEA,B185D0.72
DSND-SERINEA,B,C,D3BOG0.72
DSND-SERINEA1XVK0.72
DSND-SERINEA,C1XVR0.72
DSND-SERINEA,L1ZEA0.72
DSND-SERINEA,B,C,D1UHG0.72
DSND-SERINEA1T5M0.72
DSND-SERINEC,D193D0.72
DSND-SERINEA2V3U0.72
DSND-SERINEA,B3GO30.72
DSND-SERINEA,B2RCB0.72
DSND-SERINEA1T5N0.72
DSND-SERINEB2HH40.72
DSND-SERINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
1YWH0.72
DSND-SERINEA,B,C2UZP0.72
DSND-SERINEA1TD40.72
DSND-SERINEA1PB80.72
DSND-SERINEA1PFE0.72
DSND-SERINEA,B2DA80.72
DSND-SERINEA2JUE0.72
DSND-SERINEA1XT70.72
DSND-SERINEA2IH00.72
DSND-SERINEA,B2RC80.72
DSND-SERINEA,B2Q330.72
4TP4-HYDROXY-L-THREONINE-5-MONOPHOSPHATEA,B1PS60.85
ACB3-METHYL-ASPARTIC ACIDC,F,G,H3DW80.71
ACB3-METHYL-ASPARTIC ACIDA,B,C,D,E,F,
G,H
2NYL0.71
ACB3-METHYL-ASPARTIC ACIDA1EVD0.71
ACB3-METHYL-ASPARTIC ACIDA1EVB0.71
ACB3-METHYL-ASPARTIC ACIDA1EVA0.71
ACB3-METHYL-ASPARTIC ACIDA1LCM0.71
ACB3-METHYL-ASPARTIC ACIDA,B,C,D,E,F,
G,H
2NYM0.71
ACB3-METHYL-ASPARTIC ACIDA1AY30.71
ACB3-METHYL-ASPARTIC ACIDA,B,M,N1FJM0.71
ACB3-METHYL-ASPARTIC ACIDC,I2IE30.71
ACB3-METHYL-ASPARTIC ACIDC,F,X,Y2NPP0.71
ACB3-METHYL-ASPARTIC ACIDC,F,M,N2IAE0.71
ACB3-METHYL-ASPARTIC ACIDA1EVC0.71
AVG2-AMINO-4-(2-AMINO-ETHOXY)-BUTYRIC ACIDA1IAY0.75
ASIL-ISO-ASPARTATEA1EJC0.71
ASIL-ISO-ASPARTATEA,B1EJD0.71
ASIL-ISO-ASPARTATEA,B,C,D1YBG0.71
ASIL-ISO-ASPARTATEA,B,C,D,E,F,
G,H
1RYW0.71
ASIL-ISO-ASPARTATEA,B,C,D2Z2C0.71
ASIL-ISO-ASPARTATEA,B,C,D1JG30.71
ASIL-ISO-ASPARTATEA,B1DLG0.71
ASIL-ISO-ASPARTATEA,B,C,D2HSE0.71
ASIL-ISO-ASPARTATEA1EYN0.71
ASIL-ISO-ASPARTATEA2JV00.71
ASIL-ISO-ASPARTATEA,B,C,D,E,F,
G,H,I,J,K,L,
W,X,Y,Z
1Q3G0.71
AHBBETA-HYDROXYASPARAGINEA1DSR0.72
AHBBETA-HYDROXYASPARAGINEA,G1NT00.72
AHBBETA-HYDROXYASPARAGINEA2ZGD0.72
AHBBETA-HYDROXYASPARAGINEA,B2QC90.72
AHBBETA-HYDROXYASPARAGINEA2OG70.72
A0A(2S)-2-AMINO-4-(FORMYLOXY)-4-OXOBUTANOIC ACIDA,B2VJM0.72
ASBASPARTIC ACID-4-CARBOXYMETHYL ESTERA,B1QQ60.78
ASBASPARTIC ACID-4-CARBOXYMETHYL ESTERA,B1QQ70.78