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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03686188

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
ASBASPARTIC ACID-4-CARBOXYMETHYL ESTERA,B1QQ60.92
ASBASPARTIC ACID-4-CARBOXYMETHYL ESTERA,B1QQ70.92
OXXOXALYL-ASPARTYL ANHYDRIDEA,B1T4C0.88
ASLASPARTIC ACID-4-CARBOXYETHYL ESTERA,B2NO50.87
ASIL-ISO-ASPARTATEA1EJC0.75
ASIL-ISO-ASPARTATEA,B1EJD0.75
ASIL-ISO-ASPARTATEA,B,C,D1YBG0.75
ASIL-ISO-ASPARTATEA,B,C,D,E,F,
G,H
1RYW0.75
ASIL-ISO-ASPARTATEA,B,C,D2Z2C0.75
ASIL-ISO-ASPARTATEA,B,C,D1JG30.75
ASIL-ISO-ASPARTATEA,B1DLG0.75
ASIL-ISO-ASPARTATEA,B,C,D2HSE0.75
ASIL-ISO-ASPARTATEA1EYN0.75
ASIL-ISO-ASPARTATEA2JV00.75
ASIL-ISO-ASPARTATEA,B,C,D,E,F,
G,H,I,J,K,L,
W,X,Y,Z
1Q3G0.75
IASBETA-ASPARTYL RESIDUE (GAMMA-LINKED)A1RTU0.75
IASBETA-ASPARTYL RESIDUE (GAMMA-LINKED)A1AT60.75
IASBETA-ASPARTYL RESIDUE (GAMMA-LINKED)E,I2FTL0.75
IASBETA-ASPARTYL RESIDUE (GAMMA-LINKED)A,B1DY50.75
IASBETA-ASPARTYL RESIDUE (GAMMA-LINKED)A,B2FTM0.75
IASBETA-ASPARTYL RESIDUE (GAMMA-LINKED)E,I2FI40.75
IASBETA-ASPARTYL RESIDUE (GAMMA-LINKED)E,I2FI50.75
IASBETA-ASPARTYL RESIDUE (GAMMA-LINKED)A1C9P0.75
IASBETA-ASPARTYL RESIDUE (GAMMA-LINKED)A,B1LSQ0.75
A0A(2S)-2-AMINO-4-(FORMYLOXY)-4-OXOBUTANOIC ACIDA,B2VJM0.75
DASD-ASPARTIC ACIDA1BFW0.75
DASD-ASPARTIC ACIDA,B,C,H,K,L2R5D0.75
DASD-ASPARTIC ACIDA1KS70.75
DASD-ASPARTIC ACIDA1C4B0.75
DASD-ASPARTIC ACIDA,B,C,D3BOG0.75
DASD-ASPARTIC ACIDA,L1ZEA0.75
DASD-ASPARTIC ACIDA,B,C,D1HG10.75
DASD-ASPARTIC ACIDA,B,C,H,K,L2R5B0.75
DASD-ASPARTIC ACIDA,B2Q330.75
DASD-ASPARTIC ACIDE1AN10.75
AVG2-AMINO-4-(2-AMINO-ETHOXY)-BUTYRIC ACIDA1IAY0.75
0AK(2S)-2-amino-4-(2-chloroethoxy)-
4-oxobutanoic acid
A2DHD0.75
HSLHOMOSERINE LACTONEA1X5V0.75
HSLHOMOSERINE LACTONEA2BR60.75
HSLHOMOSERINE LACTONEA1Y4E0.75
HSLHOMOSERINE LACTONEA,B,C,D1H0M0.75
BHDBETA-HYDROXYASPARTIC ACIDA1WHE0.74
BHDBETA-HYDROXYASPARTIC ACIDA2DDE0.74
BHDBETA-HYDROXYASPARTIC ACIDC,L1XKA0.74
BHDBETA-HYDROXYASPARTIC ACIDA1ERM0.74
BHDBETA-HYDROXYASPARTIC ACIDL,P1AUT0.74
BHDBETA-HYDROXYASPARTIC ACIDA1WHF0.74
BHDBETA-HYDROXYASPARTIC ACIDL1PFX0.74
BHDBETA-HYDROXYASPARTIC ACIDA,B,C,D1XKB0.74
HSEL-HOMOSERINEA2VDJ0.73
HSEL-HOMOSERINEA,B,C,D1EBU0.73
HSEL-HOMOSERINEA,C1J9N0.73
HSEL-HOMOSERINEA1PQP0.73
HSEL-HOMOSERINEC1H720.73
HSEL-HOMOSERINEE,F3DKS0.73
B3S(3R)-3-AMINO-4-HYDROXYBUTANOIC ACIDA2OXK0.73
B3S(3R)-3-AMINO-4-HYDROXYBUTANOIC ACIDA,B,C2OXJ0.73
B3S(3R)-3-AMINO-4-HYDROXYBUTANOIC ACIDA1J8N0.73
UN22-AMINO-4,4-DIHYDROXYBUTANOIC ACIDA,B,C,D1H0G0.72
CANCANALINEA,B,C2CAN0.72
BFDASPARTATE BERYLLIUM TRIFLUORIDEA2JCM0.72
BFDASPARTATE BERYLLIUM TRIFLUORIDEA,B1J970.72
BFDASPARTATE BERYLLIUM TRIFLUORIDEA,B2G070.72
BFDASPARTATE BERYLLIUM TRIFLUORIDEA1TA00.72
BFDASPARTATE BERYLLIUM TRIFLUORIDEA,B,C,D1RLO0.72
BFDASPARTATE BERYLLIUM TRIFLUORIDEA,B1ZDM0.72
BFDASPARTATE BERYLLIUM TRIFLUORIDEA3EF10.72
BFDASPARTATE BERYLLIUM TRIFLUORIDEE,F,G,H2FTK0.72
BFDASPARTATE BERYLLIUM TRIFLUORIDEA,B2HEG0.72
2AS(2S,3S)-3-amino-2-methyl-4-oxobutanoic acidA,B,C,D,E,F,
G,H,I,J,K,L
1W3M0.71
3MD2S,3S-3-METHYLASPARTIC ACIDA,B1KKR0.71
3MD2S,3S-3-METHYLASPARTIC ACIDA,B,C,D1I9C0.71
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
OHSO-(CARBOXYSULFANYL)-4-OXO-L-HOMOSERINEA,C1Y9A0.7