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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02229334

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
DSGD-ASPARAGINEA,B2Q330.88
DSGD-ASPARAGINEA2IH00.88
DSGD-ASPARAGINEA2JUE0.88
DSGD-ASPARAGINEA1A850.88
DSGD-ASPARAGINEA1T5N0.88
DSGD-ASPARAGINEA2IGZ0.88
DSGD-ASPARAGINEA,B,C,D3BOG0.88
DSGD-ASPARAGINEA1T5M0.88
DSGD-ASPARAGINEA,B1HXB0.88
MENN-METHYL ASPARAGINEA,B,K,L1B8D0.78
MENN-METHYL ASPARAGINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R,
S,T,U,V,W,X
1GH00.78
MENN-METHYL ASPARAGINEA,B,C,D1XF60.78
MENN-METHYL ASPARAGINEA,B,C,D,E,F,
H,I,J,K,L,M
1B330.78
MENN-METHYL ASPARAGINEA,B1I7Y0.78
MENN-METHYL ASPARAGINEA,B3BRP0.78
MENN-METHYL ASPARAGINEA,B1JBO0.78
MENN-METHYL ASPARAGINEA,B1ALL0.78
MENN-METHYL ASPARAGINEA,B,K,L1EYX0.78
MENN-METHYL ASPARAGINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R,
S,T,U,V,W,X
1HA70.78
MENN-METHYL ASPARAGINEA,B,C,D2VJH0.78
MENN-METHYL ASPARAGINEA,B1KTP0.78
MENN-METHYL ASPARAGINEA,B1PHN0.78
MENN-METHYL ASPARAGINEA,B,C,D1QGW0.78
MENN-METHYL ASPARAGINEA,B,C,D1XG00.78
MENN-METHYL ASPARAGINEA,B2VJT0.78
MENN-METHYL ASPARAGINEA,B,C,D,E,F,
K,L,M,N,O,P
2BV80.78
MENN-METHYL ASPARAGINEA,B2V8A0.78
MENN-METHYL ASPARAGINEA,B,C,D,E,F,
G,H
3DBJ0.78
IASBETA-ASPARTYL RESIDUE (GAMMA-LINKED)A1RTU0.7
IASBETA-ASPARTYL RESIDUE (GAMMA-LINKED)A1AT60.7
IASBETA-ASPARTYL RESIDUE (GAMMA-LINKED)E,I2FTL0.7
IASBETA-ASPARTYL RESIDUE (GAMMA-LINKED)A,B1DY50.7
IASBETA-ASPARTYL RESIDUE (GAMMA-LINKED)A,B2FTM0.7
IASBETA-ASPARTYL RESIDUE (GAMMA-LINKED)E,I2FI40.7
IASBETA-ASPARTYL RESIDUE (GAMMA-LINKED)E,I2FI50.7
IASBETA-ASPARTYL RESIDUE (GAMMA-LINKED)A1C9P0.7
IASBETA-ASPARTYL RESIDUE (GAMMA-LINKED)A,B1LSQ0.7
193(2S)-4-(BETA-ALANYLAMINO)-2-AMINOBUTANOIC ACIDA1XY50.73
AHBBETA-HYDROXYASPARAGINEA1DSR0.71
AHBBETA-HYDROXYASPARAGINEA,G1NT00.71
AHBBETA-HYDROXYASPARAGINEA2ZGD0.71
AHBBETA-HYDROXYASPARAGINEA,B2QC90.71
AHBBETA-HYDROXYASPARAGINEA2OG70.71
DAB2,4-DIAMINOBUTYRIC ACIDA,B,C,D1J730.77
DAB2,4-DIAMINOBUTYRIC ACIDA1JDK0.77
DAB2,4-DIAMINOBUTYRIC ACIDA,B,C,D3D3S0.77
DAB2,4-DIAMINOBUTYRIC ACIDA,B3DS90.77
DAB2,4-DIAMINOBUTYRIC ACIDA1J9V0.77
DAB2,4-DIAMINOBUTYRIC ACIDA2PM10.77
DAB2,4-DIAMINOBUTYRIC ACIDA1JAR0.77
DAB2,4-DIAMINOBUTYRIC ACIDA,B1B4H0.77
NSNN~2~-(2-AMINO-1-METHYL-2-OXOETHYLIDENE)ASPARAGINATEA1UHE0.71
ASIL-ISO-ASPARTATEA1EJC0.7
ASIL-ISO-ASPARTATEA,B1EJD0.7
ASIL-ISO-ASPARTATEA,B,C,D1YBG0.7
ASIL-ISO-ASPARTATEA,B,C,D,E,F,
G,H
1RYW0.7
ASIL-ISO-ASPARTATEA,B,C,D2Z2C0.7
ASIL-ISO-ASPARTATEA,B,C,D1JG30.7
ASIL-ISO-ASPARTATEA,B1DLG0.7
ASIL-ISO-ASPARTATEA,B,C,D2HSE0.7
ASIL-ISO-ASPARTATEA1EYN0.7
ASIL-ISO-ASPARTATEA2JV00.7
ASIL-ISO-ASPARTATEA,B,C,D,E,F,
G,H,I,J,K,L,
W,X,Y,Z
1Q3G0.7
BFDASPARTATE BERYLLIUM TRIFLUORIDEA2JCM0.71
BFDASPARTATE BERYLLIUM TRIFLUORIDEA,B1J970.71
BFDASPARTATE BERYLLIUM TRIFLUORIDEA,B2G070.71
BFDASPARTATE BERYLLIUM TRIFLUORIDEA1TA00.71
BFDASPARTATE BERYLLIUM TRIFLUORIDEA,B,C,D1RLO0.71
BFDASPARTATE BERYLLIUM TRIFLUORIDEA,B1ZDM0.71
BFDASPARTATE BERYLLIUM TRIFLUORIDEA3EF10.71
BFDASPARTATE BERYLLIUM TRIFLUORIDEE,F,G,H2FTK0.71
BFDASPARTATE BERYLLIUM TRIFLUORIDEA,B2HEG0.71
DMHN4,N4-DIMETHYL-ASPARAGINEE,F,G,H1NKK0.78
DMHN4,N4-DIMETHYL-ASPARAGINEA,B,C,D,E,F,
G,H
1NJT0.78
DMHN4,N4-DIMETHYL-ASPARAGINEE,F,G,H1NJU0.78
DMHN4,N4-DIMETHYL-ASPARAGINEY,Z1JQ70.78
DMHN4,N4-DIMETHYL-ASPARAGINEC1NKM0.78
DASD-ASPARTIC ACIDA1BFW0.7
DASD-ASPARTIC ACIDA,B,C,H,K,L2R5D0.7
DASD-ASPARTIC ACIDA1KS70.7
DASD-ASPARTIC ACIDA1C4B0.7
DASD-ASPARTIC ACIDA,B,C,D3BOG0.7
DASD-ASPARTIC ACIDA,L1ZEA0.7
DASD-ASPARTIC ACIDA,B,C,D1HG10.7
DASD-ASPARTIC ACIDA,B,C,H,K,L2R5B0.7
DASD-ASPARTIC ACIDA,B2Q330.7
DASD-ASPARTIC ACIDE1AN10.7