MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03079173

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
AVG	2-AMINO-4-(2-AMINO-ETHOXY)-BUTYRIC ACID	A	1IAY	0.71
FGA	5-oxo-D-norvaline	C,F,G,H	3DW8	0.72
FGA	5-oxo-D-norvaline	A,B,C,D,E,F, G,H	2NYL	0.72
FGA	5-oxo-D-norvaline	C,F,M,N	2IAE	0.72
FGA	5-oxo-D-norvaline	A,B,C,D,E,F, G,H	2NYM	0.72
ACB	3-METHYL-ASPARTIC ACID	C,F,G,H	3DW8	0.7
ACB	3-METHYL-ASPARTIC ACID	A,B,C,D,E,F, G,H	2NYL	0.7
ACB	3-METHYL-ASPARTIC ACID	A	1EVD	0.7
ACB	3-METHYL-ASPARTIC ACID	A	1EVB	0.7
ACB	3-METHYL-ASPARTIC ACID	A	1EVA	0.7
ACB	3-METHYL-ASPARTIC ACID	A	1LCM	0.7
ACB	3-METHYL-ASPARTIC ACID	A,B,C,D,E,F, G,H	2NYM	0.7
ACB	3-METHYL-ASPARTIC ACID	A	1AY3	0.7
ACB	3-METHYL-ASPARTIC ACID	A,B,M,N	1FJM	0.7
ACB	3-METHYL-ASPARTIC ACID	C,I	2IE3	0.7
ACB	3-METHYL-ASPARTIC ACID	C,F,X,Y	2NPP	0.7
ACB	3-METHYL-ASPARTIC ACID	C,F,M,N	2IAE	0.7
ACB	3-METHYL-ASPARTIC ACID	A	1EVC	0.7
AS2	(2R)-2-AMINO-4-OXOBUTANOIC ACID	A,B,C,D	2GZ3	0.93
ABA	ALPHA-AMINOBUTYRIC ACID	A	1A3P	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	A,S	1RBD	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	A,B	1ZII	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	M,N,O,P	2ZSW	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	A	1T9E	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	C,D	2OJU	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	B,D,F,H,J,L, N,P,R,T	2RMA	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	A,B	1B6M	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	A,B	1Z1H	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	A	1CYA	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	A,B,D	1MF8	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	A,B,D	2J9K	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	D,E,F	1XQ7	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	B,D,F,H,J,L, N,P	1C5F	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	A,B,I	8HVP	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	A	1W9N	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	C	1CWA	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	A	1MQX	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	E,S	1Z3L	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	A,B,C	7HVP	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	A,B	1B6J	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	C	1IKF	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	A,B	3BXS	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	A,M,N	2Z6W	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	A,B	1D4K	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	A,B,I	4HVP	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	A	2JUV	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	A	1AJ1	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	B	3CYS	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	A,B	1YLC	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	A	1C2U	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	A,B,C	2J9J	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	C	1CWB	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	A,B,C,D,E,F	1QOW	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	D	1QNG	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	A	9JDW	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	A	1CYB	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	A	1WZ5	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	A	3HVP	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	A,B	1B6P	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	C	1CYN	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	A,B	1MTR	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	B,D,F,H	2RMC	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	A	1BBO	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	A,B,D,E,F,H	1M63	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	E,F	2ZOL	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	A,B	3BXR	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	C	1CWM	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	A	1CSA	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	A,B	1D4L	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	C	1CWL	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	A,B	1Z1R	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	A,C,F,H	2C5V	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	A,B,C,D,E,F	2ZSV	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	A,C,E,G,I,J, K,L	2ZOK	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	B,D,F,H,J,L, N,P,R,T	2RMB	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	A	1MQZ	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	A,B,C,D,E,F, I,J,K,L,M,N	2ESL	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	C	1CWH	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	A,B,C,D,E,F, G,H	3BO7	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	A,B	1YLD	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	A,B,I	3DCR	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	A,I	2O40	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	A,B	1K09	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	B	1T1Q	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	A,B	1B6K	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	A	1MQY	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	A,B,I	3DCK	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	A,B	1B6L	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	A	2DDE	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	A,B,C	1CPI	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	A,B,C	1ZIJ	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	A	1BAH	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	C,D	1QNH	0.73
ABA	ALPHA-AMINOBUTYRIC ACID	T,U,V	2POY	0.73
ASI	L-ISO-ASPARTATE	A	1EJC	0.78
ASI	L-ISO-ASPARTATE	A,B	1EJD	0.78
ASI	L-ISO-ASPARTATE	A,B,C,D	1YBG	0.78
ASI	L-ISO-ASPARTATE	A,B,C,D,E,F, G,H	1RYW	0.78
ASI	L-ISO-ASPARTATE	A,B,C,D	2Z2C	0.78
ASI	L-ISO-ASPARTATE	A,B,C,D	1JG3	0.78
ASI	L-ISO-ASPARTATE	A,B	1DLG	0.78
ASI	L-ISO-ASPARTATE	A,B,C,D	2HSE	0.78
ASI	L-ISO-ASPARTATE	A	1EYN	0.78
ASI	L-ISO-ASPARTATE	A	2JV0	0.78
ASI	L-ISO-ASPARTATE	A,B,C,D,E,F, G,H,I,J,K,L, W,X,Y,Z	1Q3G	0.78
A0A	(2S)-2-AMINO-4-(FORMYLOXY)-4-OXOBUTANOIC ACID	A,B	2VJM	0.79
B3S	(3R)-3-AMINO-4-HYDROXYBUTANOIC ACID	A	2OXK	0.76
B3S	(3R)-3-AMINO-4-HYDROXYBUTANOIC ACID	A,B,C	2OXJ	0.76
B3S	(3R)-3-AMINO-4-HYDROXYBUTANOIC ACID	A	1J8N	0.76
CAN	CANALINE	A,B,C	2CAN	0.74
DBB	D-ALPHA-AMINOBUTYRIC ACID	L,N	1WCO	0.73
DBB	D-ALPHA-AMINOBUTYRIC ACID	C	1CWC	0.73
DBB	D-ALPHA-AMINOBUTYRIC ACID	E,I	1QR3	0.73
DBB	D-ALPHA-AMINOBUTYRIC ACID	A,F,L,S	2D7F	0.73
DSG	D-ASPARAGINE	A,B	2Q33	0.7
DSG	D-ASPARAGINE	A	2IH0	0.7
DSG	D-ASPARAGINE	A	2JUE	0.7
DSG	D-ASPARAGINE	A	1A85	0.7
DSG	D-ASPARAGINE	A	1T5N	0.7
DSG	D-ASPARAGINE	A	2IGZ	0.7
DSG	D-ASPARAGINE	A,B,C,D	3BOG	0.7
DSG	D-ASPARAGINE	A	1T5M	0.7
DSG	D-ASPARAGINE	A,B	1HXB	0.7
0AA	methyl L-valinate	I	1HEF	0.72
BFD	ASPARTATE BERYLLIUM TRIFLUORIDE	A	2JCM	0.74
BFD	ASPARTATE BERYLLIUM TRIFLUORIDE	A,B	1J97	0.74
BFD	ASPARTATE BERYLLIUM TRIFLUORIDE	A,B	2G07	0.74
BFD	ASPARTATE BERYLLIUM TRIFLUORIDE	A	1TA0	0.74
BFD	ASPARTATE BERYLLIUM TRIFLUORIDE	A,B,C,D	1RLO	0.74
BFD	ASPARTATE BERYLLIUM TRIFLUORIDE	A,B	1ZDM	0.74
BFD	ASPARTATE BERYLLIUM TRIFLUORIDE	A	3EF1	0.74
BFD	ASPARTATE BERYLLIUM TRIFLUORIDE	E,F,G,H	2FTK	0.74
BFD	ASPARTATE BERYLLIUM TRIFLUORIDE	A,B	2HEG	0.74
2AS	(2S,3S)-3-amino-2-methyl-4-oxobutanoic acid	A,B,C,D,E,F, G,H,I,J,K,L	1W3M	0.7
HSL	HOMOSERINE LACTONE	A	1X5V	0.78
HSL	HOMOSERINE LACTONE	A	2BR6	0.78
HSL	HOMOSERINE LACTONE	A	1Y4E	0.78
HSL	HOMOSERINE LACTONE	A,B,C,D	1H0M	0.78
ASA	ASPARTIC ALDEHYDE	E,F	2QLF	0.88
ASA	ASPARTIC ALDEHYDE	C	3H11	0.88
ASA	ASPARTIC ALDEHYDE	D,E,F	2QL9	0.88
ASA	ASPARTIC ALDEHYDE	C	2H5I	0.88
ASA	ASPARTIC ALDEHYDE	E,F	2H65	0.88
ASA	ASPARTIC ALDEHYDE	A,B	1IAU	0.88
ASA	ASPARTIC ALDEHYDE	A,E,F	2QLJ	0.88
ASA	ASPARTIC ALDEHYDE	E,F	2H5J	0.88
ASA	ASPARTIC ALDEHYDE	D,E,F	2QL5	0.88
ASA	ASPARTIC ALDEHYDE	D,E,F	2QL7	0.88
ASA	ASPARTIC ALDEHYDE	E,F	3EDR	0.88
ASA	ASPARTIC ALDEHYDE	A,B,C	1QTN	0.88
ASA	ASPARTIC ALDEHYDE	D,E,F	2QLB	0.88
CAB	4-CARBOXY-4-AMINOBUTANAL	A,B,M,N	1FJM	0.72
CAB	4-CARBOXY-4-AMINOBUTANAL	C,I	2IE3	0.72
CAB	4-CARBOXY-4-AMINOBUTANAL	C,F,X,Y	2NPP	0.72
CAB	4-CARBOXY-4-AMINOBUTANAL	A,B	1DJO	0.72
HSE	L-HOMOSERINE	A	2VDJ	0.76
HSE	L-HOMOSERINE	A,B,C,D	1EBU	0.76
HSE	L-HOMOSERINE	A,C	1J9N	0.76
HSE	L-HOMOSERINE	A	1PQP	0.76
HSE	L-HOMOSERINE	C	1H72	0.76
HSE	L-HOMOSERINE	E,F	3DKS	0.76
DAS	D-ASPARTIC ACID	A	1BFW	0.78
DAS	D-ASPARTIC ACID	A,B,C,H,K,L	2R5D	0.78
DAS	D-ASPARTIC ACID	A	1KS7	0.78
DAS	D-ASPARTIC ACID	A	1C4B	0.78
DAS	D-ASPARTIC ACID	A,B,C,D	3BOG	0.78
DAS	D-ASPARTIC ACID	A,L	1ZEA	0.78
DAS	D-ASPARTIC ACID	A,B,C,D	1HG1	0.78
DAS	D-ASPARTIC ACID	A,B,C,H,K,L	2R5B	0.78
DAS	D-ASPARTIC ACID	A,B	2Q33	0.78
DAS	D-ASPARTIC ACID	E	1AN1	0.78
3MD	2S,3S-3-METHYLASPARTIC ACID	A,B	1KKR	0.7
3MD	2S,3S-3-METHYLASPARTIC ACID	A,B,C,D	1I9C	0.7