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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02310241

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
PEDPENTANE-3,4-DIOL-5-PHOSPHATEA,E1LWW0.71
PEDPENTANE-3,4-DIOL-5-PHOSPHATEA,C1ORN0.71
PEDPENTANE-3,4-DIOL-5-PHOSPHATEA,C1ORP0.71
PEDPENTANE-3,4-DIOL-5-PHOSPHATEA,B,C,D,E,F2FCC0.71
PEDPENTANE-3,4-DIOL-5-PHOSPHATEA,E1LWV0.71
PEDPENTANE-3,4-DIOL-5-PHOSPHATEA,C2EA00.71
PEDPENTANE-3,4-DIOL-5-PHOSPHATEA,E1HU00.71
PEDPENTANE-3,4-DIOL-5-PHOSPHATEA,B,C,D,I,J,
K,L
1K820.71
PEDPENTANE-3,4-DIOL-5-PHOSPHATEA,C1L1Z0.71
PEDPENTANE-3,4-DIOL-5-PHOSPHATEE1LWY0.71
PEDPENTANE-3,4-DIOL-5-PHOSPHATEA,B,D,F2OQ40.71
PEDPENTANE-3,4-DIOL-5-PHOSPHATEA,B,C1K3X0.71
PEDPENTANE-3,4-DIOL-5-PHOSPHATEA,C1K3W0.71
PEDPENTANE-3,4-DIOL-5-PHOSPHATEA,C2OPF0.71
PEQL-PHOSPHOLACTATEA,B,C,D,E,F,
G,H
1AQF0.78
PEQL-PHOSPHOLACTATEA,B3FJ70.78
13P1,3-DIHYDROXYACETONEPHOSPHATEA,B1K8Y0.74
13P1,3-DIHYDROXYACETONEPHOSPHATEA,B,C,D1FDJ0.74
13P1,3-DIHYDROXYACETONEPHOSPHATEA,B3BXE0.74
13P1,3-DIHYDROXYACETONEPHOSPHATEA,B,C,D1ADO0.74
13P1,3-DIHYDROXYACETONEPHOSPHATEA,B,C,D2QUU0.74
13P1,3-DIHYDROXYACETONEPHOSPHATEA,B2R4E0.74
13P1,3-DIHYDROXYACETONEPHOSPHATEA,B1NF00.74
13P1,3-DIHYDROXYACETONEPHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R,
S,T
2QJH0.74
13P1,3-DIHYDROXYACETONEPHOSPHATEA,B,C,D3DFO0.74
13P1,3-DIHYDROXYACETONEPHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R,
S,T
2QJI0.74
13P1,3-DIHYDROXYACETONEPHOSPHATEA,B,C,D,E,F,
G,H,I,J
1OK40.74
13P1,3-DIHYDROXYACETONEPHOSPHATEA3BV40.74
13P1,3-DIHYDROXYACETONEPHOSPHATEA,B,C,D3DFS0.74
13P1,3-DIHYDROXYACETONEPHOSPHATES1E480.74
13P1,3-DIHYDROXYACETONEPHOSPHATEA3EKZ0.74
13P1,3-DIHYDROXYACETONEPHOSPHATEA3EKL0.74
13P1,3-DIHYDROXYACETONEPHOSPHATEA,B1WPQ0.74
13P1,3-DIHYDROXYACETONEPHOSPHATEA,B,C,D1J4E0.74
13P1,3-DIHYDROXYACETONEPHOSPHATEA,B2R4J0.74
13P1,3-DIHYDROXYACETONEPHOSPHATEA2V2A0.74
13P1,3-DIHYDROXYACETONEPHOSPHATEA,B,C,D2QUT0.74
13P1,3-DIHYDROXYACETONEPHOSPHATEA,B3BXF0.74
13P1,3-DIHYDROXYACETONEPHOSPHATEA,B,C,D2FJK0.74
13P1,3-DIHYDROXYACETONEPHOSPHATES1E470.74
13P1,3-DIHYDROXYACETONEPHOSPHATEA,B1NEY0.74
F6RFRUCTOSE -6-PHOSPHATEA,B1X9H0.71
F6RFRUCTOSE -6-PHOSPHATEA,B,C,D2PUT0.71
F6RFRUCTOSE -6-PHOSPHATEA,B2BKX0.71
F6RFRUCTOSE -6-PHOSPHATEA,B,C2BPL0.71
F6RFRUCTOSE -6-PHOSPHATEA,B1FQO0.71
F6RFRUCTOSE -6-PHOSPHATEA,B,C,D2V4M0.71
2PG2-PHOSPHOGLYCERIC ACIDA,B2AL10.81
2PG2-PHOSPHOGLYCERIC ACIDA,B1ZJI0.81
2PG2-PHOSPHOGLYCERIC ACIDA5ENL0.81
2PG2-PHOSPHOGLYCERIC ACIDA,B1ONE0.81
2PG2-PHOSPHOGLYCERIC ACIDA,B2R450.81
2PG2-PHOSPHOGLYCERIC ACIDA1O980.81
2PG2-PHOSPHOGLYCERIC ACIDA7ENL0.81
2PG2-PHOSPHOGLYCERIC ACIDA1EQJ0.81
2PG2-PHOSPHOGLYCERIC ACIDA,B2AL20.81
2PG2-PHOSPHOGLYCERIC ACIDA,B1O5X0.81
2PG2-PHOSPHOGLYCERIC ACIDA,B1PE10.81
2PG2-PHOSPHOGLYCERIC ACIDA,B1P430.81
2PG2-PHOSPHOGLYCERIC ACIDA1O990.81
2PG2-PHOSPHOGLYCERIC ACIDB4TIM0.81
2PG2-PHOSPHOGLYCERIC ACIDA,B2ONE0.81
MRU5-S-METHYL-1-O-PHOSPHONO-5-THIO-
D-RIBULOSE
A,B,C,D2YVK0.73
3PG3-PHOSPHOGLYCERIC ACIDA2P9T0.81
3PG3-PHOSPHOGLYCERIC ACIDB,E,H,L1AA10.81
3PG3-PHOSPHOGLYCERIC ACIDA,B,C,D3FJG0.81
3PG3-PHOSPHOGLYCERIC ACIDB1IIH0.81
3PG3-PHOSPHOGLYCERIC ACIDA,B3FDZ0.81
3PG3-PHOSPHOGLYCERIC ACIDA,B2VFE0.81
3PG3-PHOSPHOGLYCERIC ACIDA,B3GP50.81
3PG3-PHOSPHOGLYCERIC ACIDA,B2PAA0.81
3PG3-PHOSPHOGLYCERIC ACIDA1VPE0.81
3PG3-PHOSPHOGLYCERIC ACIDA1QPG0.81
3PG3-PHOSPHOGLYCERIC ACIDA,B1RUS0.81
3PG3-PHOSPHOGLYCERIC ACIDA,B3C3A0.81
3PG3-PHOSPHOGLYCERIC ACIDA,B2A9J0.81
3PG3-PHOSPHOGLYCERIC ACIDA,B2H4X0.81
3PG3-PHOSPHOGLYCERIC ACIDA,B2HHJ0.81
3PG3-PHOSPHOGLYCERIC ACIDA,B2H520.81
3PG3-PHOSPHOGLYCERIC ACIDA,B2VFH0.81
3PG3-PHOSPHOGLYCERIC ACIDA3E250.81
3PG3-PHOSPHOGLYCERIC ACIDA1HDI0.81
3PG3-PHOSPHOGLYCERIC ACIDA,B2CUN0.81
3PG3-PHOSPHOGLYCERIC ACIDA,B3PGM0.81
3PG3-PHOSPHOGLYCERIC ACIDA,B,C,D13PK0.81
3PG3-PHOSPHOGLYCERIC ACIDA,B,C,D2VFG0.81
3PG3-PHOSPHOGLYCERIC ACIDA,B2VFI0.81
3PG3-PHOSPHOGLYCERIC ACIDA1EJJ0.81
3PG3-PHOSPHOGLYCERIC ACIDA,B1M7O0.81
3PG3-PHOSPHOGLYCERIC ACIDA,B2F900.81
3PG3-PHOSPHOGLYCERIC ACIDA,B1QHF0.81
3PG3-PHOSPHOGLYCERIC ACIDA,B3C3C0.81
3PG3-PHOSPHOGLYCERIC ACIDA,B,C,E,F,G2ABM0.81
3PG3-PHOSPHOGLYCERIC ACIDA3PGK0.81
3PG3-PHOSPHOGLYCERIC ACIDA,B3C390.81
3PG3-PHOSPHOGLYCERIC ACIDA1KF00.81
3PG3-PHOSPHOGLYCERIC ACIDA2JDD0.81
5RPRIBULOSE-5-PHOSPHATEA,B1XBY0.79
5RPRIBULOSE-5-PHOSPHATEA,B1XBX0.79
5RPRIBULOSE-5-PHOSPHATEA1UJ50.79
5RPRIBULOSE-5-PHOSPHATEA,B1PVY0.79
5RPRIBULOSE-5-PHOSPHATEA2RIU0.79
5RPRIBULOSE-5-PHOSPHATEA,B1SNN0.79
5RPRIBULOSE-5-PHOSPHATEA,B1TKU0.79
5RPRIBULOSE-5-PHOSPHATEA,B3HHE0.79
5RPRIBULOSE-5-PHOSPHATEA,B1XBV0.79
5RPRIBULOSE-5-PHOSPHATEA,B,C2ISS0.79
5RPRIBULOSE-5-PHOSPHATEA,B,C2IYP0.79
5RPRIBULOSE-5-PHOSPHATEA,B,C,D,E2VVP0.79
DXP1-DEOXY-D-XYLULOSE-5-PHOSPHATEB,C,D,E,F,G,H3GK00.86
DXP1-DEOXY-D-XYLULOSE-5-PHOSPHATEA,B,C,E,F,G1M5W0.86
DXP1-DEOXY-D-XYLULOSE-5-PHOSPHATEA,B,C,D1IXN0.86
DXP1-DEOXY-D-XYLULOSE-5-PHOSPHATEA,B1Q0Q0.86
3PB(3R)-3-(phosphonooxy)butanoic acidA,B,C,D,E,F3FG80.73
DEZ4-PHOSPHO-D-ERYTHRONATEA,B,C,D,E2BET0.77
DG22,3-DIPHOSPHOGLYCERIC ACIDA,B,C,D1B860.73
DG22,3-DIPHOSPHOGLYCERIC ACIDA,B2H4Z0.73
DG22,3-DIPHOSPHOGLYCERIC ACIDA,B3FDZ0.73
DG22,3-DIPHOSPHOGLYCERIC ACIDA,B2HHJ0.73
HMS5-O-phosphono-L-ribuloseA,B1XBX0.79
DRZ3',4'-DIHYDROXY-PENTANAL-5'-PHOSPHATEA,C1M3Q0.71
G3HGLYCERALDEHYDE-3-PHOSPHATEA,B1M7P0.83
G3HGLYCERALDEHYDE-3-PHOSPHATEA,C,O,Q1NQO0.83
G3HGLYCERALDEHYDE-3-PHOSPHATEA,B1UOD0.83
G3HGLYCERALDEHYDE-3-PHOSPHATEA,B2OKG0.83
G3HGLYCERALDEHYDE-3-PHOSPHATEA,B3CEP0.83
G3HGLYCERALDEHYDE-3-PHOSPHATEA,B2CLK0.83
G3HGLYCERALDEHYDE-3-PHOSPHATEA,B,C,D3CIF0.83
G3HGLYCERALDEHYDE-3-PHOSPHATEA1UXU0.83
G3HGLYCERALDEHYDE-3-PHOSPHATEF,G1GLC0.83
G3HGLYCERALDEHYDE-3-PHOSPHATEO,P,Q,R3CMC0.83
G3HGLYCERALDEHYDE-3-PHOSPHATEF,G1GLE0.83
G3HGLYCERALDEHYDE-3-PHOSPHATEA,B,C,D1QI10.83
G3HGLYCERALDEHYDE-3-PHOSPHATEG1GLD0.83
G3HGLYCERALDEHYDE-3-PHOSPHATEA,B,C,D2ESD0.83
G3HGLYCERALDEHYDE-3-PHOSPHATEA,B1C7Z0.83
G3HGLYCERALDEHYDE-3-PHOSPHATEO,P,Q,R1NQA0.83
G3HGLYCERALDEHYDE-3-PHOSPHATEA,B,C,D2QE00.83
G3HGLYCERALDEHYDE-3-PHOSPHATEA,B1Z820.83
HPV2-oxo-3-(phosphonooxy)propanoic acidA,B3DDN0.74
LI52-HYDROXY-4,5-DIOXOHEPTYL HYDROGEN PHOSPHONATEA,B1YCD0.73
FPE3-FLUORO-2-(PHOSPHONOOXY)PROPANOIC ACIDA1PL90.72
FPE3-FLUORO-2-(PHOSPHONOOXY)PROPANOIC ACIDA1PHQ0.72
E4PERYTHOSE-4-PHOSPHATEA,B1NGS0.82
E4PERYTHOSE-4-PHOSPHATEA,B1U0G0.82
E4PERYTHOSE-4-PHOSPHATEA,B1FWT0.82
E4PERYTHOSE-4-PHOSPHATEA,B1RZM0.82
E4PERYTHOSE-4-PHOSPHATEA,B,C,D1IRI0.82
DERD-4-PHOSPHOERYTHRONIC ACIDA,B,C,D1LK70.77
DERD-4-PHOSPHOERYTHRONIC ACIDA,B2CXO0.77