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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03213525

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
CGFC-(1-AZIDO-ALPHA-D-GLUCOPYRANOSYL) FORMAMIDEA1P4G0.71
MMN5-DEOXY-5-{[(1S)-1-HYDROXYETHYL]AMINO}-
D-GLUCITOL
A1XUZ0.72
GCSD-GLUCOSAMINEA3CO40.72
GCSD-GLUCOSAMINEA1QGI0.72
GCSD-GLUCOSAMINEA,B2VZS0.72
GCSD-GLUCOSAMINEA1E9L0.72
GCSD-GLUCOSAMINEA,B,C,D3FXI0.72
GCSD-GLUCOSAMINEA,B2VZV0.72
PA1PAROMOMYCIN (RING 1)A1PBR0.72
PA1PAROMOMYCIN (RING 1)A1QKC0.72
PA1PAROMOMYCIN (RING 1)A1QFG0.72
PA1PAROMOMYCIN (RING 1)A1FI10.72
PA1PAROMOMYCIN (RING 1)A,B,C,D3FXI0.72
PA1PAROMOMYCIN (RING 1)A1QFF0.72
NEB2-DEOXY-D-STREPTAMINEA1NEM0.79
CHA1-HYDROXY-2-AMINO-3-CYCLOHEXYLPROPANEA,B1HRN0.7
CHA1-HYDROXY-2-AMINO-3-CYCLOHEXYLPROPANEA1EAG0.7
CHA1-HYDROXY-2-AMINO-3-CYCLOHEXYLPROPANEA,B1BIM0.7
CHA1-HYDROXY-2-AMINO-3-CYCLOHEXYLPROPANEA,B1BIL0.7
CGBCALYSTEGINE B2A,B2CBV0.71
AGP2-DEOXY-2-AMINO GLUCITOL-6-PHOSPHATEA,B,C,D,E,F1NE70.75
AGP2-DEOXY-2-AMINO GLUCITOL-6-PHOSPHATEA2ZJ40.75
AGP2-DEOXY-2-AMINO GLUCITOL-6-PHOSPHATEA1MOS0.75
AGP2-DEOXY-2-AMINO GLUCITOL-6-PHOSPHATEA,B1HOR0.75
NOJ1-DEOXYNOJIRIMYCINA,B1OIM0.71
NOJ1-DEOXYNOJIRIMYCINA,B2J770.71
NOJ1-DEOXYNOJIRIMYCINA,B2JKE0.71
NOJ1-DEOXYNOJIRIMYCINA3GBE0.71
NOJ1-DEOXYNOJIRIMYCINA,B3GXT0.71
NOJ1-DEOXYNOJIRIMYCINA,B1DIE0.71
NOJ1-DEOXYNOJIRIMYCINA1DOG0.71
NOJ1-DEOXYNOJIRIMYCINA,B1I750.71
NOJ1-DEOXYNOJIRIMYCINA,B2PWD0.71
DMJ1-DEOXYMANNOJIRIMYCINA,B1KRE0.71
DMJ1-DEOXYMANNOJIRIMYCINA1FO20.71
DMJ1-DEOXYMANNOJIRIMYCINA1G6I0.71
DMJ1-DEOXYMANNOJIRIMYCINA1HXK0.71
CYY2-DEOXYSTREPTAMINEA1QD30.79
M6R5-AMINO-5-DEOXY-1-O-PHOSPHONO-D-
MANNITOL
A,B,C,D2PUV0.75
AOL(1R,2R,3S,4S,5R)-5-AMINOCYCLOPENTANE-
1,2,3,4-TETROL
A2F7Q0.73
XAOCYCLOHEXYLMETHYL-2,3-DIHYDROXY-
5-METHYL-HEXYLAMIDE
A1FQ60.79
XAOCYCLOHEXYLMETHYL-2,3-DIHYDROXY-
5-METHYL-HEXYLAMIDE
I,J1PSA0.79
XAOCYCLOHEXYLMETHYL-2,3-DIHYDROXY-
5-METHYL-HEXYLAMIDE
E,I1EPQ0.79
YHO(1S,2S,3R,4R)-4-aminocyclopentane-
1,2,3-triol
A3DX10.71
TOB1,3-DIAMINO-5,6-DIHYDROXYCYCLOHEXANEA1TOB0.76
GCN3-DEOXY-D-GLUCOSAMINEA1FI10.72
GCN3-DEOXY-D-GLUCOSAMINEA1QFG0.72
GCN3-DEOXY-D-GLUCOSAMINEA1QKC0.72
GCN3-DEOXY-D-GLUCOSAMINEA,B2GRX0.72
GCN3-DEOXY-D-GLUCOSAMINEA1QJQ0.72
GCN3-DEOXY-D-GLUCOSAMINEA1QFF0.72
1GN2-DEOXY-2-AMINOGALACTOSEA,B3GAL0.72
2TB1,3-DIAMINO-4,5,6-TRIHYDROXY-CYCLOHEXANEA2TOB0.81
PA2PAROMOMYCIN (RING 2)B1O9M0.75
PA2PAROMOMYCIN (RING 2)A1PBR0.75