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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03660758

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
GRF5-O-PHOSPHONO-BETA-D-RIBOFURANOSYLAMINEA1ZLY0.73
GCN3-DEOXY-D-GLUCOSAMINEA1FI10.71
GCN3-DEOXY-D-GLUCOSAMINEA1QFG0.71
GCN3-DEOXY-D-GLUCOSAMINEA1QKC0.71
GCN3-DEOXY-D-GLUCOSAMINEA,B2GRX0.71
GCN3-DEOXY-D-GLUCOSAMINEA1QJQ0.71
GCN3-DEOXY-D-GLUCOSAMINEA1QFF0.71
NEB2-DEOXY-D-STREPTAMINEA1NEM0.88
GE23,5-DIAMINO-CYCLOHEXANOLA1BYJ0.75
AGP2-DEOXY-2-AMINO GLUCITOL-6-PHOSPHATEA,B,C,D,E,F1NE70.89
AGP2-DEOXY-2-AMINO GLUCITOL-6-PHOSPHATEA2ZJ40.89
AGP2-DEOXY-2-AMINO GLUCITOL-6-PHOSPHATEA1MOS0.89
AGP2-DEOXY-2-AMINO GLUCITOL-6-PHOSPHATEA,B1HOR0.89
BDGO-2,6-DIAMINO-2,6-DIDEOXY-ALPHA-
D-GLUCOPYRANOSE
A1QD30.7
BDGO-2,6-DIAMINO-2,6-DIDEOXY-ALPHA-
D-GLUCOPYRANOSE
B1O9M0.7
BDGO-2,6-DIAMINO-2,6-DIDEOXY-ALPHA-
D-GLUCOPYRANOSE
A1NEM0.7
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
GL6(3,4,5-TRIHYDROXY-6-HYDROXYMETHYL-
TETRAHYDRO-PYRAN-2-YL)-PHOSPHORAMIDIC ACID DIMETHYL ESTER
A1XC70.75
PA2PAROMOMYCIN (RING 2)B1O9M0.83
PA2PAROMOMYCIN (RING 2)A1PBR0.83
CYY2-DEOXYSTREPTAMINEA1QD30.88
1GN2-DEOXY-2-AMINOGALACTOSEA,B3GAL0.71
H4P1-DEOXY-6-O-PHOSPHONO-1-[(PHOSPHONOMETHYL)AMINO]-
L-THREO-HEXITOL
A,B1PCW0.74
M6R5-AMINO-5-DEOXY-1-O-PHOSPHONO-D-
MANNITOL
A,B,C,D2PUV0.89
AOL(1R,2R,3S,4S,5R)-5-AMINOCYCLOPENTANE-
1,2,3,4-TETROL
A2F7Q0.73
NNG2-DEOXY-2-{[(S)-HYDROXY(METHYL)PHOSPHORYL]AMINO}-
6-O-PHOSPHONO-ALPHA-D-GLUCOPYRANOSE
A,B2P530.74
YHO(1S,2S,3R,4R)-4-aminocyclopentane-
1,2,3-triol
A3DX10.71
YTB(1R,2R,3S,4R,5R)-5-aminocyclopentane-
1,2,3,4-tetrol
A3DX30.73
GP1GLUCOSAMINE 1-PHOSPHATEA,B,C1Q9W0.79
GP1GLUCOSAMINE 1-PHOSPHATEA,B2OI60.79
GP1GLUCOSAMINE 1-PHOSPHATEA2FCP0.79
GP1GLUCOSAMINE 1-PHOSPHATEA1FCP0.79
GP1GLUCOSAMINE 1-PHOSPHATEA1UJW0.79
PA1PAROMOMYCIN (RING 1)A1PBR0.71
PA1PAROMOMYCIN (RING 1)A1QKC0.71
PA1PAROMOMYCIN (RING 1)A1QFG0.71
PA1PAROMOMYCIN (RING 1)A1FI10.71
PA1PAROMOMYCIN (RING 1)A,B,C,D3FXI0.71
PA1PAROMOMYCIN (RING 1)A1QFF0.71
GP4GLUCOSAMINE 4-PHOSPHATEA1FCP0.79
GP4GLUCOSAMINE 4-PHOSPHATEA,B,C1Q9W0.79
GP4GLUCOSAMINE 4-PHOSPHATEA2FCP0.79
GCSD-GLUCOSAMINEA3CO40.71
GCSD-GLUCOSAMINEA1QGI0.71
GCSD-GLUCOSAMINEA,B2VZS0.71
GCSD-GLUCOSAMINEA1E9L0.71
GCSD-GLUCOSAMINEA,B,C,D3FXI0.71
GCSD-GLUCOSAMINEA,B2VZV0.71
IDGO-2,6-DIAMINO-2,6-DIDEOXY-BETA-
L-IDOPYRANOSE
A1QD30.7
IDGO-2,6-DIAMINO-2,6-DIDEOXY-BETA-
L-IDOPYRANOSE
A1NEM0.7
IDGO-2,6-DIAMINO-2,6-DIDEOXY-BETA-
L-IDOPYRANOSE
A1PBR0.7
GLPGLUCOSAMINE 6-PHOSPHATEE,F,G,H,P,Q,
R,S
2NZ40.79
GLPGLUCOSAMINE 6-PHOSPHATEA1MOQ0.79
GLPGLUCOSAMINE 6-PHOSPHATEA3CXQ0.79
GLPGLUCOSAMINE 6-PHOSPHATEA,B3B4A0.79
GLPGLUCOSAMINE 6-PHOSPHATEA,B3B4C0.79
GLPGLUCOSAMINE 6-PHOSPHATEA,B3B4B0.79
GLPGLUCOSAMINE 6-PHOSPHATEA,B2VHL0.79
GLPGLUCOSAMINE 6-PHOSPHATEA,B2Z750.79
GLPGLUCOSAMINE 6-PHOSPHATEX2VF50.79
GLPGLUCOSAMINE 6-PHOSPHATEA,B2RI10.79
2TB1,3-DIAMINO-4,5,6-TRIHYDROXY-CYCLOHEXANEA2TOB0.87
TOB1,3-DIAMINO-5,6-DIHYDROXYCYCLOHEXANEA1TOB0.82