MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02348925

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
GAU	(4S)-4-AMINO-5-HYDROXYPENTANOIC ACID	A,B,C,D	2CV1	0.8
GAU	(4S)-4-AMINO-5-HYDROXYPENTANOIC ACID	A,B,C,D	2DXI	0.8
CGA	CARBOXYMETHYLATED GLUTAMIC ACID	A	1DET	0.71
DNE	D-NORLEUCINE	A	1R9V	0.71
DNE	D-NORLEUCINE	A,B	1S4A	0.71
DNE	D-NORLEUCINE	A,B	1S1O	0.71
B3E	(3S)-3-AMINOHEXANEDIOIC ACID	A	3C3G	0.73
B3E	(3S)-3-AMINOHEXANEDIOIC ACID	A	2OXK	0.73
B3E	(3S)-3-AMINOHEXANEDIOIC ACID	A,B,C,D	3C3F	0.73
B3E	(3S)-3-AMINOHEXANEDIOIC ACID	A,B,C	3HEZ	0.73
B3E	(3S)-3-AMINOHEXANEDIOIC ACID	A,B,C	2OXJ	0.73
AA4	2-AMINO-5-HYDROXYPENTANOIC ACID	B	1MIK	0.76
AA4	2-AMINO-5-HYDROXYPENTANOIC ACID	E,I	1QR3	0.76
DIL	D-ISOLEUCINE	A,B	2Q33	0.71
DIL	D-ISOLEUCINE	A	1CWZ	0.71
DIL	D-ISOLEUCINE	A	1CVQ	0.71
DIL	D-ISOLEUCINE	A	1C4B	0.71
DIL	D-ISOLEUCINE	A	1CW8	0.71
DIL	D-ISOLEUCINE	A	2AP8	0.71
IIL	ISO-ISOLEUCINE	A,B,C,D	1Q4V	0.71
IIL	ISO-ISOLEUCINE	A	1KMF	0.71
IIL	ISO-ISOLEUCINE	A,B,C	1TGG	0.71
IIL	ISO-ISOLEUCINE	A	1RH4	0.71
0AA	methyl L-valinate	I	1HEF	0.71
ILG	GLUTAMYL GROUP	A	1EVC	0.75
ILG	GLUTAMYL GROUP	A	1XY5	0.75
ILG	GLUTAMYL GROUP	A	1EVA	0.75
ILG	GLUTAMYL GROUP	A	1LCM	0.75
ILG	GLUTAMYL GROUP	C,D	2GSR	0.75
ILG	GLUTAMYL GROUP	A	1XY4	0.75
ILG	GLUTAMYL GROUP	A,B,C,D,E,F, G,H	1AQX	0.75
ILG	GLUTAMYL GROUP	A,B,C,D,E,F, G,H	1AQW	0.75
ILG	GLUTAMYL GROUP	A	1EVB	0.75
ILG	GLUTAMYL GROUP	A,B,C,D	1I7Q	0.75
ILG	GLUTAMYL GROUP	A,B	1GAC	0.75
ILG	GLUTAMYL GROUP	A	1EVD	0.75
ILG	GLUTAMYL GROUP	A,B,C,D	1AQV	0.75
EKE	(4S,5R)-4-AMINO-5-HYDROXYHEXANOIC ACID	A,I	2HAL	0.71
GVE	METHYL 4-AMINOBUTANOATE	A,B,C,D	2J7Q	0.83
GVE	METHYL 4-AMINOBUTANOATE	A,B,C,D	1XD3	0.83
VIG	4-AMINO HEXANOIC ACID	A,B,C,D	1OHW	0.79
DGL	D-GLUTAMIC ACID	A,B	2JFX	0.73
DGL	D-GLUTAMIC ACID	A,B,C,H,K,L	2R5D	0.73
DGL	D-GLUTAMIC ACID	A	1C4B	0.73
DGL	D-GLUTAMIC ACID	A	1CW8	0.73
DGL	D-GLUTAMIC ACID	A,D	1CZQ	0.73
DGL	D-GLUTAMIC ACID	A,B	2JFY	0.73
DGL	D-GLUTAMIC ACID	I	1QUR	0.73
DGL	D-GLUTAMIC ACID	A,D	2Q3I	0.73
DGL	D-GLUTAMIC ACID	A	1CVQ	0.73
DGL	D-GLUTAMIC ACID	A,B	1P4N	0.73
DGL	D-GLUTAMIC ACID	A,B	2VVT	0.73
DGL	D-GLUTAMIC ACID	E,S	148L	0.73
DGL	D-GLUTAMIC ACID	A	1KR6	0.73
DGL	D-GLUTAMIC ACID	A,B,C,D	2GZM	0.73
DGL	D-GLUTAMIC ACID	A	1AY3	0.73
DGL	D-GLUTAMIC ACID	A	2J8F	0.73
DGL	D-GLUTAMIC ACID	U	2AIZ	0.73
DGL	D-GLUTAMIC ACID	A,B,C	2DWU	0.73
DGL	D-GLUTAMIC ACID	L	2EAX	0.73
DGL	D-GLUTAMIC ACID	A,B	2JFZ	0.73
DGL	D-GLUTAMIC ACID	H,I	4THN	0.73
DGL	D-GLUTAMIC ACID	A	1CWZ	0.73
DGL	D-GLUTAMIC ACID	P	1MCK	0.73
DGL	D-GLUTAMIC ACID	A	2JUE	0.73
DGL	D-GLUTAMIC ACID	A,B	2JFO	0.73
DGL	D-GLUTAMIC ACID	A	3H41	0.73
DGL	D-GLUTAMIC ACID	A	1D0K	0.73
DGL	D-GLUTAMIC ACID	L,N	1WCO	0.73
DGL	D-GLUTAMIC ACID	A,B,C	1ZUW	0.73
DGL	D-GLUTAMIC ACID	H,I	5GDS	0.73
DGL	D-GLUTAMIC ACID	A,B,C,H,K,L	2R5B	0.73
DGL	D-GLUTAMIC ACID	A,B	2JFQ	0.73
DGL	D-GLUTAMIC ACID	A,B	2Q33	0.73
DGL	D-GLUTAMIC ACID	A,B	2JFP	0.73
DGL	D-GLUTAMIC ACID	A,B,E,F	2W4I	0.73
DGL	D-GLUTAMIC ACID	A	2J8G	0.73
DGL	D-GLUTAMIC ACID	A,B,C,D	2R3C	0.73
FGA	5-oxo-D-norvaline	C,F,G,H	3DW8	0.75
FGA	5-oxo-D-norvaline	A,B,C,D,E,F, G,H	2NYL	0.75
FGA	5-oxo-D-norvaline	C,F,M,N	2IAE	0.75
FGA	5-oxo-D-norvaline	A,B,C,D,E,F, G,H	2NYM	0.75
HOZ	(4S)-4,5-DIAMINOPENTANOIC ACID	A,B	2HOZ	0.74
HOZ	(4S)-4,5-DIAMINOPENTANOIC ACID	A,B	2HP2	0.74
HOZ	(4S)-4,5-DIAMINOPENTANOIC ACID	A,B	2HP1	0.74
NLE	NORLEUCINE	A	1MMT	0.71
NLE	NORLEUCINE	A,B	1JB6	0.71
NLE	NORLEUCINE	C	1K2B	0.71
NLE	NORLEUCINE	A,B,C	2AVQ	0.71
NLE	NORLEUCINE	C,D,I,L	1R1L	0.71
NLE	NORLEUCINE	E,S	2RLN	0.71
NLE	NORLEUCINE	E,S	1Z3L	0.71
NLE	NORLEUCINE	A,B,C	2AOD	0.71
NLE	NORLEUCINE	A,B,C	2J9J	0.71
NLE	NORLEUCINE	A,B,I	4HVP	0.71
NLE	NORLEUCINE	A,B,C	2AVM	0.71
NLE	NORLEUCINE	B,C	1K1T	0.71
NLE	NORLEUCINE	A,B,C	2AOC	0.71
NLE	NORLEUCINE	A,B,C	2JE4	0.71
NLE	NORLEUCINE	A,B,I	3DCK	0.71
NLE	NORLEUCINE	B	1EOL	0.71
NLE	NORLEUCINE	A	1FF0	0.71
NLE	NORLEUCINE	A	1FG6	0.71
NLE	NORLEUCINE	A	1FGC	0.71
NLE	NORLEUCINE	E,S	1Z3M	0.71
NLE	NORLEUCINE	A	2RME	0.71
NLE	NORLEUCINE	B	1FGL	0.71
NLE	NORLEUCINE	C	1K1U	0.71
NLE	NORLEUCINE	A,B	1B7H	0.71
NLE	NORLEUCINE	A	1HTH	0.71
NLE	NORLEUCINE	A,B,D	2J9K	0.71
NLE	NORLEUCINE	A	2RMD	0.71
NLE	NORLEUCINE	A,B,C	2AOG	0.71
NLE	NORLEUCINE	A	2RMI	0.71
NLE	NORLEUCINE	I	1EPO	0.71
NLE	NORLEUCINE	A	1FFI	0.71
NLE	NORLEUCINE	A	1HD9	0.71
NLE	NORLEUCINE	A	1FFF	0.71
NLE	NORLEUCINE	B	2JND	0.71
NLE	NORLEUCINE	A	1FEJ	0.71
NLE	NORLEUCINE	A	2K9E	0.71
NLE	NORLEUCINE	C	1CFN	0.71
NLE	NORLEUCINE	C	1K2C	0.71
NLE	NORLEUCINE	A	1WY4	0.71
NLE	NORLEUCINE	A	1FQ8	0.71
NLE	NORLEUCINE	A,B	1S1O	0.71
NLE	NORLEUCINE	A	2F4K	0.71
NLE	NORLEUCINE	A,B	1D5E	0.71
NLE	NORLEUCINE	A	2JX4	0.71
NLE	NORLEUCINE	A	1FG8	0.71
NLE	NORLEUCINE	A	1WY3	0.71
NLE	NORLEUCINE	I	1YTJ	0.71
NLE	NORLEUCINE	A,B,I	3DCR	0.71
NLE	NORLEUCINE	A,I	2O40	0.71
NLE	NORLEUCINE	A,B	2GYP	0.71
NLE	NORLEUCINE	C,F	1A8K	0.71
NLE	NORLEUCINE	C	1BAI	0.71
NLE	NORLEUCINE	A,B	2JT9	0.71
NLE	NORLEUCINE	A	2RM9	0.71
NLE	NORLEUCINE	A,B	1DAZ	0.71
NLE	NORLEUCINE	A	1F3R	0.71
NLE	NORLEUCINE	A,I	2JXR	0.71
NLE	NORLEUCINE	C,F	1A94	0.71
NLE	NORLEUCINE	A,B	1S4A	0.71
NLE	NORLEUCINE	A	1R9V	0.71
NLE	NORLEUCINE	A,B,C,D,E,F	2Z2T	0.71
VME	METHYL L-VALINATE	A,B,C	2JE4	0.71
VME	METHYL L-VALINATE	A,B,C	2J9J	0.71
VME	METHYL L-VALINATE	A,B,C	7HVP	0.71
DLE	D-LEUCINE	A,B	1ALZ	0.71
DLE	D-LEUCINE	A,B	1BDW	0.71
DLE	D-LEUCINE	A,D	1CZQ	0.71
DLE	D-LEUCINE	A	1BFW	0.71
DLE	D-LEUCINE	E,F,G,H	1XN2	0.71
DLE	D-LEUCINE	A,B,C,D	1GMK	0.71
DLE	D-LEUCINE	A,B	1TKQ	0.71
DLE	D-LEUCINE	A,B,C,H,K,L	2R5D	0.71
DLE	D-LEUCINE	A	2NPV	0.71
DLE	D-LEUCINE	A,B,C,D	2R3C	0.71
DLE	D-LEUCINE	B,D,E	1AFQ	0.71
DLE	D-LEUCINE	A,B	1MIC	0.71
DLE	D-LEUCINE	A,B	1NRU	0.71
DLE	D-LEUCINE	A,B	1JNO	0.71
DLE	D-LEUCINE	A,B	1GRM	0.71
DLE	D-LEUCINE	A,B	1NRM	0.71
DLE	D-LEUCINE	A,D	2Q3I	0.71
DLE	D-LEUCINE	A,B	1NT5	0.71
DLE	D-LEUCINE	A	2JUE	0.71
DLE	D-LEUCINE	A,B,C,D	1AV2	0.71
DLE	D-LEUCINE	A	1YY2	0.71
DLE	D-LEUCINE	A,B	1AL4	0.71
DLE	D-LEUCINE	A,B	1NG8	0.71
DLE	D-LEUCINE	A,B	1ALX	0.71
DLE	D-LEUCINE	A,B	1JO4	0.71
DLE	D-LEUCINE	A,B,C,H,K,L	2R5B	0.71
DLE	D-LEUCINE	A,B	1MAG	0.71
DLE	D-LEUCINE	A,B	1NT6	0.71
DLE	D-LEUCINE	A,B	2Q33	0.71
DLE	D-LEUCINE	A,B	1JO3	0.71
DLE	D-LEUCINE	E,I	1BLL	0.71
DLE	D-LEUCINE	A,B	1KQE	0.71
DLE	D-LEUCINE	A,B,C,D	1W5U	0.71
DLE	D-LEUCINE	A,B,C,D	2IZQ	0.71
DLE	D-LEUCINE	A	1C4B	0.71
DLE	D-LEUCINE	A,B,C,D	1C4D	0.71
MKE	(4S)-4-AMINO-5-OXOHEXANOIC ACID	A,I	2HAL	0.7
LED	(4R)-5-OXO-L-LEUCINE	A	2IUW	0.71
NLO	O-METHYL-L-NORLEUCINE	A,B	1S4A	0.78
ABU	GAMMA-AMINO-BUTANOIC ACID	E,I,J	1M1A	0.71
ABU	GAMMA-AMINO-BUTANOIC ACID	D,I,J	1M18	0.71
ABU	GAMMA-AMINO-BUTANOIC ACID	A	2OKK	0.71
ABU	GAMMA-AMINO-BUTANOIC ACID	I	1QUR	0.71
ABU	GAMMA-AMINO-BUTANOIC ACID	E,I,J	1M19	0.71
ABU	GAMMA-AMINO-BUTANOIC ACID	A,B	2OKJ	0.71
ABU	GAMMA-AMINO-BUTANOIC ACID	A,B	1CGL	0.71
ABU	GAMMA-AMINO-BUTANOIC ACID	A	6JDW	0.71
ABU	GAMMA-AMINO-BUTANOIC ACID	A,D,E,G,I,J	1S32	0.71
ABU	GAMMA-AMINO-BUTANOIC ACID	A,B	2JT9	0.71
MLL	METHYL L-LEUCINATE	C,F,M,N	2IAE	0.78
NVA	NORVALINE	B,C	1CA8	0.77
NVA	NORVALINE	B,C,D	1BA8	0.77
NVA	NORVALINE	A	1C9Y	0.77
NVA	NORVALINE	A,D	2BTE	0.77
NVA	NORVALINE	A	1OBH	0.77
NVA	NORVALINE	E,S	1Z3P	0.77
NVA	NORVALINE	A	1ZNM	0.77
NVA	NORVALINE	A	1JDX	0.77
NVA	NORVALINE	A	1FB5	0.77
NVA	NORVALINE	A	1OBC	0.77
NVA	NORVALINE	1	1YYY	0.77
NVA	NORVALINE	A,B	1B6H	0.77
NVA	NORVALINE	A,B	1ZZZ	0.77
NVA	NORVALINE	A,B,C	2I6U	0.77
NVA	NORVALINE	B,C	1BB0	0.77
NVA	NORVALINE	E,S	1Z3M	0.77
CAB	4-CARBOXY-4-AMINOBUTANAL	A,B,M,N	1FJM	0.75
CAB	4-CARBOXY-4-AMINOBUTANAL	C,I	2IE3	0.75
CAB	4-CARBOXY-4-AMINOBUTANAL	C,F,X,Y	2NPP	0.75
CAB	4-CARBOXY-4-AMINOBUTANAL	A,B	1DJO	0.75