MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00014356

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

Ligand	Ligand name	Chain	PDB	Tanimoto	Ligand in PDB
Ligand	Ligand name	Chain	PDB	Tanimoto	Ligand in PDB
DAB	2,4-DIAMINOBUTYRIC ACID	A,B,C,D	1J73	0.93
DAB	2,4-DIAMINOBUTYRIC ACID	A	1JDK	0.93
DAB	2,4-DIAMINOBUTYRIC ACID	A,B,C,D	3D3S	0.93
DAB	2,4-DIAMINOBUTYRIC ACID	A,B	3DS9	0.93
DAB	2,4-DIAMINOBUTYRIC ACID	A	1J9V	0.93
DAB	2,4-DIAMINOBUTYRIC ACID	A	2PM1	0.93
DAB	2,4-DIAMINOBUTYRIC ACID	A	1JAR	0.93
DAB	2,4-DIAMINOBUTYRIC ACID	A,B	1B4H	0.93
FGA	5-oxo-D-norvaline	C,F,G,H	3DW8	0.7
FGA	5-oxo-D-norvaline	A,B,C,D,E,F, G,H	2NYL	0.7
FGA	5-oxo-D-norvaline	C,F,M,N	2IAE	0.7
FGA	5-oxo-D-norvaline	A,B,C,D,E,F, G,H	2NYM	0.7
AA4	2-AMINO-5-HYDROXYPENTANOIC ACID	B	1MIK	0.71
AA4	2-AMINO-5-HYDROXYPENTANOIC ACID	E,I	1QR3	0.71
DVA	D-VALINE	A,B,C,D	1C4D	0.73
DVA	D-VALINE	A,B,C,D	3BOG	0.73
DVA	D-VALINE	A,B,C,D	1GMK	0.73
DVA	D-VALINE	A	209D	0.73
DVA	D-VALINE	A,B	1TKQ	0.73
DVA	D-VALINE	A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P,Q,R, S,T,U,V,W,X	1UNJ	0.73
DVA	D-VALINE	A,B	1MIC	0.73
DVA	D-VALINE	A,B	1NRU	0.73
DVA	D-VALINE	A	1DSD	0.73
DVA	D-VALINE	B	1L1V	0.73
DVA	D-VALINE	A,B	1JNO	0.73
DVA	D-VALINE	A,B	1NRM	0.73
DVA	D-VALINE	A,B	1NT5	0.73
DVA	D-VALINE	A	2JUE	0.73
DVA	D-VALINE	A,B,C,D	1AV2	0.73
DVA	D-VALINE	A,B	2FCN	0.73
DVA	D-VALINE	A,B	1A7Z	0.73
DVA	D-VALINE	A,B	1AL4	0.73
DVA	D-VALINE	A,B	1NG8	0.73
DVA	D-VALINE	A	2D55	0.73
DVA	D-VALINE	A	1DSC	0.73
DVA	D-VALINE	A,B	1ALX	0.73
DVA	D-VALINE	A,B	1JO4	0.73
DVA	D-VALINE	A,B	1MAG	0.73
DVA	D-VALINE	A,B	1NT6	0.73
DVA	D-VALINE	A,B	2Q33	0.73
DVA	D-VALINE	A,B	1JO3	0.73
DVA	D-VALINE	C,D	1MNV	0.73
DVA	D-VALINE	A,B	1KQE	0.73
DVA	D-VALINE	A,B,C,D	1W5U	0.73
DVA	D-VALINE	A,B,C,D	2IZQ	0.73
DVA	D-VALINE	A,B,C,D,E,F	1UNM	0.73
DVA	D-VALINE	A,C,D	1S4V	0.73
DVA	D-VALINE	A,B	1OVF	0.73
DVA	D-VALINE	A,L	1ZEA	0.73
DVA	D-VALINE	A,B	1ALZ	0.73
DVA	D-VALINE	A,B,C	1A7Y	0.73
DVA	D-VALINE	A,B	173D	0.73
DVA	D-VALINE	A,B	1BDW	0.73
DVA	D-VALINE	A,B	1FJA	0.73
DVA	D-VALINE	A	1BFW	0.73
DVA	D-VALINE	A,B,C,D	1I3W	0.73
DVA	D-VALINE	A	316D	0.73
DVA	D-VALINE	A,B,C	1QFI	0.73
DVA	D-VALINE	A,B	1GRM	0.73
B3A	(3S)-3-AMINOBUTANOIC ACID	A,B,C	2OXJ	0.7
B3A	(3S)-3-AMINOBUTANOIC ACID	A,B,C	3HEZ	0.7
B3A	(3S)-3-AMINOBUTANOIC ACID	A	2OXK	0.7
ABU	GAMMA-AMINO-BUTANOIC ACID	E,I,J	1M1A	0.78
ABU	GAMMA-AMINO-BUTANOIC ACID	D,I,J	1M18	0.78
ABU	GAMMA-AMINO-BUTANOIC ACID	A	2OKK	0.78
ABU	GAMMA-AMINO-BUTANOIC ACID	I	1QUR	0.78
ABU	GAMMA-AMINO-BUTANOIC ACID	E,I,J	1M19	0.78
ABU	GAMMA-AMINO-BUTANOIC ACID	A,B	2OKJ	0.78
ABU	GAMMA-AMINO-BUTANOIC ACID	A,B	1CGL	0.78
ABU	GAMMA-AMINO-BUTANOIC ACID	A	6JDW	0.78
ABU	GAMMA-AMINO-BUTANOIC ACID	A,D,E,G,I,J	1S32	0.78
ABU	GAMMA-AMINO-BUTANOIC ACID	A,B	2JT9	0.78
DGN	D-GLUTAMINE	A,D	2Q3I	0.71
DGN	D-GLUTAMINE	A,L	1ZEA	0.71
DGN	D-GLUTAMINE	A,B	2FCM	0.71
DGN	D-GLUTAMINE	A	1BFW	0.71
DGN	D-GLUTAMINE	E	1EPR	0.71
DGN	D-GLUTAMINE	A	2JX4	0.71
DGN	D-GLUTAMINE	A,B,C,D	2R3C	0.71
DGN	D-GLUTAMINE	A,B,C,H,K,L	2R5D	0.71
DGN	D-GLUTAMINE	A,B	2Q33	0.71
DGN	D-GLUTAMINE	A,B,C,H,K,L	2R5B	0.71
DGN	D-GLUTAMINE	A,B,C	1YJ1	0.71
DGN	D-GLUTAMINE	A	1B74	0.71
CAN	CANALINE	A,B,C	2CAN	0.72
DGL	D-GLUTAMIC ACID	A,B	2JFX	0.75
DGL	D-GLUTAMIC ACID	A,B,C,H,K,L	2R5D	0.75
DGL	D-GLUTAMIC ACID	A	1C4B	0.75
DGL	D-GLUTAMIC ACID	A	1CW8	0.75
DGL	D-GLUTAMIC ACID	A,D	1CZQ	0.75
DGL	D-GLUTAMIC ACID	A,B	2JFY	0.75
DGL	D-GLUTAMIC ACID	I	1QUR	0.75
DGL	D-GLUTAMIC ACID	A,D	2Q3I	0.75
DGL	D-GLUTAMIC ACID	A	1CVQ	0.75
DGL	D-GLUTAMIC ACID	A,B	1P4N	0.75
DGL	D-GLUTAMIC ACID	A,B	2VVT	0.75
DGL	D-GLUTAMIC ACID	E,S	148L	0.75
DGL	D-GLUTAMIC ACID	A	1KR6	0.75
DGL	D-GLUTAMIC ACID	A,B,C,D	2GZM	0.75
DGL	D-GLUTAMIC ACID	A	1AY3	0.75
DGL	D-GLUTAMIC ACID	A	2J8F	0.75
DGL	D-GLUTAMIC ACID	U	2AIZ	0.75
DGL	D-GLUTAMIC ACID	A,B,C	2DWU	0.75
DGL	D-GLUTAMIC ACID	L	2EAX	0.75
DGL	D-GLUTAMIC ACID	A,B	2JFZ	0.75
DGL	D-GLUTAMIC ACID	H,I	4THN	0.75
DGL	D-GLUTAMIC ACID	A	1CWZ	0.75
DGL	D-GLUTAMIC ACID	P	1MCK	0.75
DGL	D-GLUTAMIC ACID	A	2JUE	0.75
DGL	D-GLUTAMIC ACID	A,B	2JFO	0.75
DGL	D-GLUTAMIC ACID	A	3H41	0.75
DGL	D-GLUTAMIC ACID	A	1D0K	0.75
DGL	D-GLUTAMIC ACID	L,N	1WCO	0.75
DGL	D-GLUTAMIC ACID	A,B,C	1ZUW	0.75
DGL	D-GLUTAMIC ACID	H,I	5GDS	0.75
DGL	D-GLUTAMIC ACID	A,B,C,H,K,L	2R5B	0.75
DGL	D-GLUTAMIC ACID	A,B	2JFQ	0.75
DGL	D-GLUTAMIC ACID	A,B	2Q33	0.75
DGL	D-GLUTAMIC ACID	A,B	2JFP	0.75
DGL	D-GLUTAMIC ACID	A,B,E,F	2W4I	0.75
DGL	D-GLUTAMIC ACID	A	2J8G	0.75
DGL	D-GLUTAMIC ACID	A,B,C,D	2R3C	0.75
193	(2S)-4-(BETA-ALANYLAMINO)-2-AMINOBUTANOIC ACID	A	1XY5	0.75
DSG	D-ASPARAGINE	A,B	2Q33	0.83
DSG	D-ASPARAGINE	A	2IH0	0.83
DSG	D-ASPARAGINE	A	2JUE	0.83
DSG	D-ASPARAGINE	A	1A85	0.83
DSG	D-ASPARAGINE	A	1T5N	0.83
DSG	D-ASPARAGINE	A	2IGZ	0.83
DSG	D-ASPARAGINE	A,B,C,D	3BOG	0.83
DSG	D-ASPARAGINE	A	1T5M	0.83
DSG	D-ASPARAGINE	A,B	1HXB	0.83
DBB	D-ALPHA-AMINOBUTYRIC ACID	L,N	1WCO	0.79
DBB	D-ALPHA-AMINOBUTYRIC ACID	C	1CWC	0.79
DBB	D-ALPHA-AMINOBUTYRIC ACID	E,I	1QR3	0.79
DBB	D-ALPHA-AMINOBUTYRIC ACID	A,F,L,S	2D7F	0.79
DNP	3-AMINO-ALANINE	A	1BEI	0.7
ABA	ALPHA-AMINOBUTYRIC ACID	A	1A3P	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	A,S	1RBD	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	A,B	1ZII	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	M,N,O,P	2ZSW	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	A	1T9E	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	C,D	2OJU	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	B,D,F,H,J,L, N,P,R,T	2RMA	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	A,B	1B6M	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	A,B	1Z1H	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	A	1CYA	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	A,B,D	1MF8	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	A,B,D	2J9K	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	D,E,F	1XQ7	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	B,D,F,H,J,L, N,P	1C5F	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	A,B,I	8HVP	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	A	1W9N	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	C	1CWA	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	A	1MQX	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	E,S	1Z3L	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	A,B,C	7HVP	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	A,B	1B6J	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	C	1IKF	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	A,B	3BXS	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	A,M,N	2Z6W	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	A,B	1D4K	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	A,B,I	4HVP	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	A	2JUV	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	A	1AJ1	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	B	3CYS	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	A,B	1YLC	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	A	1C2U	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	A,B,C	2J9J	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	C	1CWB	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	A,B,C,D,E,F	1QOW	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	D	1QNG	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	A	9JDW	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	A	1CYB	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	A	1WZ5	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	A	3HVP	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	A,B	1B6P	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	C	1CYN	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	A,B	1MTR	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	B,D,F,H	2RMC	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	A	1BBO	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	A,B,D,E,F,H	1M63	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	E,F	2ZOL	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	A,B	3BXR	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	C	1CWM	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	A	1CSA	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	A,B	1D4L	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	C	1CWL	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	A,B	1Z1R	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	A,C,F,H	2C5V	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	A,B,C,D,E,F	2ZSV	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	A,C,E,G,I,J, K,L	2ZOK	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	B,D,F,H,J,L, N,P,R,T	2RMB	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	A	1MQZ	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	A,B,C,D,E,F, I,J,K,L,M,N	2ESL	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	C	1CWH	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	A,B,C,D,E,F, G,H	3BO7	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	A,B	1YLD	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	A,B,I	3DCR	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	A,I	2O40	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	A,B	1K09	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	B	1T1Q	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	A,B	1B6K	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	A	1MQY	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	A,B,I	3DCK	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	A,B	1B6L	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	A	2DDE	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	A,B,C	1CPI	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	A,B,C	1ZIJ	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	A	1BAH	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	C,D	1QNH	0.79
ABA	ALPHA-AMINOBUTYRIC ACID	T,U,V	2POY	0.79
CAB	4-CARBOXY-4-AMINOBUTANAL	A,B,M,N	1FJM	0.7
CAB	4-CARBOXY-4-AMINOBUTANAL	C,I	2IE3	0.7
CAB	4-CARBOXY-4-AMINOBUTANAL	C,F,X,Y	2NPP	0.7
CAB	4-CARBOXY-4-AMINOBUTANAL	A,B	1DJO	0.7
CSE	SELENOCYSTEINE	A,B	3FWF	0.71
CSE	SELENOCYSTEINE	A,B,K,L	1H0H	0.71
CSE	SELENOCYSTEINE	A,B,C,D,E,F	3EAN	0.71
CSE	SELENOCYSTEINE	X	2IV2	0.71
CSE	SELENOCYSTEINE	A	1AA6	0.71
CSE	SELENOCYSTEINE	A	1FDO	0.71
CSE	SELENOCYSTEINE	A,B,C	1KQG	0.71
CSE	SELENOCYSTEINE	A	3FWI	0.71
CSE	SELENOCYSTEINE	A,B,C	1KQF	0.71
CSE	SELENOCYSTEINE	A	1KMK	0.71
CSE	SELENOCYSTEINE	X	1PAE	0.71
CSE	SELENOCYSTEINE	A	1PFP	0.71
CSE	SELENOCYSTEINE	L,S	1CC1	0.71
CSE	SELENOCYSTEINE	A,B,C,D,E,F	3EAO	0.71
CSE	SELENOCYSTEINE	A	1FDI	0.71
CSE	SELENOCYSTEINE	A	3FWJ	0.71
DPP	DIAMMINOPROPANOIC ACID	A,B	1B5H	0.7
DLY	D-LYSINE	A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P	1YWH	0.73
DLY	D-LYSINE	A	1C4B	0.73
DLY	D-LYSINE	A,B,C,D	3BOG	0.73
DLY	D-LYSINE	A	1KO0	0.73
DLY	D-LYSINE	A,B,C,D	3C1P	0.73
DLY	D-LYSINE	A,B,C,H,K,L	2R5D	0.73
DLY	D-LYSINE	A,B,C,D	2R3C	0.73
DLY	D-LYSINE	A,B,C,H,K,L	2R5B	0.73
DLY	D-LYSINE	A,B	2Q33	0.73
DLY	D-LYSINE	A,B	2ATS	0.73
DLY	D-LYSINE	A	1RCQ	0.73
DMH	N4,N4-DIMETHYL-ASPARAGINE	E,F,G,H	1NKK	0.73
DMH	N4,N4-DIMETHYL-ASPARAGINE	A,B,C,D,E,F, G,H	1NJT	0.73
DMH	N4,N4-DIMETHYL-ASPARAGINE	E,F,G,H	1NJU	0.73
DMH	N4,N4-DIMETHYL-ASPARAGINE	Y,Z	1JQ7	0.73
DMH	N4,N4-DIMETHYL-ASPARAGINE	C	1NKM	0.73
0AA	methyl L-valinate	I	1HEF	0.73