MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00555517

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
AME	N-ACETYLMETHIONINE	A,B,C,D	1SJA	0.7
AME	N-ACETYLMETHIONINE	A,B	2J4Y	0.7
THC	N-METHYLCARBONYLTHREONINE	A,B,C	1A7C	0.72
THC	N-METHYLCARBONYLTHREONINE	B	2HR0	0.72
THC	N-METHYLCARBONYLTHREONINE	L,P	2MPA	0.72
THC	N-METHYLCARBONYLTHREONINE	L,P	1MPA	0.72
AYA	N-ACETYLALANINE	A	1D0W	0.85
AYA	N-ACETYLALANINE	A	1AH4	0.85
AYA	N-ACETYLALANINE	A,B	1VBP	0.85
AYA	N-ACETYLALANINE	A,B,C,D,E,F, G,H	1J4T	0.85
AYA	N-ACETYLALANINE	A,B,C,D	1OUW	0.85
AYA	N-ACETYLALANINE	A	1AH3	0.85
AYA	N-ACETYLALANINE	A	1EKO	0.85
AYA	N-ACETYLALANINE	B,D,F,H	2V4I	0.85
AYA	N-ACETYLALANINE	A,B,C,D,E,F, G,H	1VBO	0.85
AYA	N-ACETYLALANINE	A,B,C,D	1J4U	0.85
NCB	N-CARBAMOYL-ALANINE	A,B,C,D,E,F, G,H,I,J	1QMV	0.75
MAA	N-METHYLALANINE	A,B	1A7Z	0.75
MAA	N-METHYLALANINE	A,B	2VSL	0.75
MAA	N-METHYLALANINE	C	1CWI	0.75
MAA	N-METHYLALANINE	C,F,G,H	3DW8	0.75
MAA	N-METHYLALANINE	A,B,C,D,E,F, G,H	2NYL	0.75
MAA	N-METHYLALANINE	D	1D5X	0.75
MAA	N-METHYLALANINE	C	1PYW	0.75
MAA	N-METHYLALANINE	A,B,C,D,E,F, G,H	2NYM	0.75
MAA	N-METHYLALANINE	C,I	2IE3	0.75
MAA	N-METHYLALANINE	C,F,X,Y	2NPP	0.75
6PR	(S)-4-AMINO-4-OXO-3-(2-PHOSPHONOACETAMIDO)BUTANOIC ACID	A,B,C,D	2H3E	0.76
P3P	(2S)-2-AMINO-4-[METHYL(PHOSPHONOOXY)PHOSPHORYL]BUTANOIC ACID	A,B,C,D,E,F, G,H,I,J	2D3C	0.75
PAL	N-(PHOSPHONACETYL)-L-ASPARTIC ACID	A,B,C	1EKX	0.84
PAL	N-(PHOSPHONACETYL)-L-ASPARTIC ACID	A,B,C,D,E,F, G,H,I,J,K,L	1Q95	0.84
PAL	N-(PHOSPHONACETYL)-L-ASPARTIC ACID	A,B,C,D	1TTH	0.84
PAL	N-(PHOSPHONACETYL)-L-ASPARTIC ACID	A,B,C,D	1ACM	0.84
PAL	N-(PHOSPHONACETYL)-L-ASPARTIC ACID	A,B,C,D	1D09	0.84
PAL	N-(PHOSPHONACETYL)-L-ASPARTIC ACID	A,B,C,D	1XJW	0.84
PAL	N-(PHOSPHONACETYL)-L-ASPARTIC ACID	A	1ML4	0.84
PAL	N-(PHOSPHONACETYL)-L-ASPARTIC ACID	B,D	1I5O	0.84
PAL	N-(PHOSPHONACETYL)-L-ASPARTIC ACID	A,B,C,D	1F1B	0.84
PAL	N-(PHOSPHONACETYL)-L-ASPARTIC ACID	A,B,C,D	8ATC	0.84
SAC	N-ACETYL-SERINE	A,B,C,D,F,G, I,J,L,M,N,O, P,Q,S,T,V,W,Z	2EIL	0.78
SAC	N-ACETYL-SERINE	A,B,C,D,F,G, I,J,L,M,N,O, P,Q,S,T,V,W,Z	2DYR	0.78
SAC	N-ACETYL-SERINE	A,B,C,D,F,G, I,J,L,M,N,O, P,S,T,V,W,Z	2EIM	0.78
SAC	N-ACETYL-SERINE	A	1R4U	0.78
SAC	N-ACETYL-SERINE	A,B,C,D	1WS3	0.78
SAC	N-ACETYL-SERINE	A,B,C,D,E,F, G,H	1XY3	0.78
SAC	N-ACETYL-SERINE	A,B	1EVU	0.78
SAC	N-ACETYL-SERINE	A,B,C,D,E,F, G,H	1R56	0.78
SAC	N-ACETYL-SERINE	A,B,C,D,F,G, I,J,L,M,N,O, P,S,T,V,W,Z	2DYS	0.78
SAC	N-ACETYL-SERINE	A	1WRR	0.78
SAC	N-ACETYL-SERINE	A,B,C,D,E,F, G,I,J,L,M,N, O,P,Q,S,T,V, W,Z	1V54	0.78
SAC	N-ACETYL-SERINE	A,B	3CVQ	0.78
SAC	N-ACETYL-SERINE	A	1B0B	0.78
SAC	N-ACETYL-SERINE	A	1XT4	0.78
SAC	N-ACETYL-SERINE	A,B,C,F,G,I, J,L,M,N,O,P, S,T,V,W,Z	2EIJ	0.78
SAC	N-ACETYL-SERINE	A	2FXL	0.78
SAC	N-ACETYL-SERINE	A	1R4S	0.78
SAC	N-ACETYL-SERINE	A,B,C,D	1WS2	0.78
SAC	N-ACETYL-SERINE	A,B,C,D	2AUC	0.78
SAC	N-ACETYL-SERINE	A,B,C,D,F,G, I,J,L,M,N,O, P,S,T,V,W,Y,Z	2EIN	0.78
SAC	N-ACETYL-SERINE	A	1R51	0.78
SAC	N-ACETYL-SERINE	A,B,C,E,F,G, I,J,M,N,O,P, Q,S,T,V,W,Z	1V55	0.78
SAC	N-ACETYL-SERINE	A,B,C,D	1XXJ	0.78
SAC	N-ACETYL-SERINE	T	2QAC	0.78
SAC	N-ACETYL-SERINE	A,B,C,E,F,G, I,J,L,M,N,O, P,Q,S,T,V,W, Y,Z	2EIK	0.78
I38	N-(3-MERCAPTOPROPANOYL)-D-ALANINE	A	2QDT	0.75
GPJ	GLYPHOSATE	A,B,C,D	1RF6	0.74
GPJ	GLYPHOSATE	A	1G6S	0.74
GPJ	GLYPHOSATE	A	2AAY	0.74
GPJ	GLYPHOSATE	A	2GGA	0.74
GPJ	GLYPHOSATE	A	2QFT	0.74
GPJ	GLYPHOSATE	A	2QFU	0.74
GPJ	GLYPHOSATE	A	2GGD	0.74
PPQ	PHOSPHINOTHRICIN	A,B,C,D,E,F, G,H,I,J,K,L	1FPY	0.77
SBG	O-[(S)-HYDROXY(METHYL)PHOSPHORYL]- L-SERINE	A,B	2WHQ	0.71
SBG	O-[(S)-HYDROXY(METHYL)PHOSPHORYL]- L-SERINE	A,B	2JGL	0.71
RE1	GLYCYL-L-A-AMINOPIMELYL-E-(D-2- AMINOETHYL)PHOSPHONATE	A	1MPL	0.71
SVX	O-[(R)-ETHOXY(METHYL)PHOSPHORYL]- L-SERINE	A,B	2JGH	0.71
AAC	ACETYLAMINO-ACETIC ACID	A,B	1NG3	0.74
AAC	ACETYLAMINO-ACETIC ACID	A	1QD8	0.74
AN0	N-ACETYL-L-NORVALINE	C,D,E,X,Y,Z	2G7M	0.75
AN0	N-ACETYL-L-NORVALINE	A	1ZQ8	0.75
SC2	N-ACETYL-L-CYSTEINE	A,B,C,D,E,F, G,H	2J58	0.76
SC2	N-ACETYL-L-CYSTEINE	A,B,C,D,E,F	2J2P	0.76
SC2	N-ACETYL-L-CYSTEINE	B,C,D,E,F	2J1G	0.76
GPF	N-(phosphonomethyl)glycine	A	3FJZ	0.74
GPF	N-(phosphonomethyl)glycine	A	3FK1	0.74
AOR	N~2~-ACETYL-L-ORNITHINE	A	1ZQ6	0.7
NLG	N-ACETYL-L-GLUTAMATE	A	1OH9	0.71
NLG	N-ACETYL-L-GLUTAMATE	A	1OHA	0.71
NLG	N-ACETYL-L-GLUTAMATE	A,B,C,D,E,F, G,H,I,J,K,L	2BUF	0.71
NLG	N-ACETYL-L-GLUTAMATE	A,B,C,D	2RD5	0.71
NLG	N-ACETYL-L-GLUTAMATE	A,B	2JJ4	0.71
NLG	N-ACETYL-L-GLUTAMATE	A,B,C,D,E,F, G,H,J,K	2V5H	0.71
NLG	N-ACETYL-L-GLUTAMATE	A	1GSJ	0.71
NLG	N-ACETYL-L-GLUTAMATE	A	3B8G	0.71
NLG	N-ACETYL-L-GLUTAMATE	A	1GS5	0.71
NLG	N-ACETYL-L-GLUTAMATE	A,B,C	2BTY	0.71
SEN	O-[N,N-dimethylphosphoramidate]- L-serine	A	3DKK	0.7
SEN	O-[N,N-dimethylphosphoramidate]- L-serine	A,B	3DL7	0.7
SN0	N-(3-CARBOXYPROPANOYL)-L-NORVALINE	A	2G65	0.71
SN0	N-(3-CARBOXYPROPANOYL)-L-NORVALINE	A	2G6A	0.71
SN0	N-(3-CARBOXYPROPANOYL)-L-NORVALINE	A	2G68	0.71
SN0	N-(3-CARBOXYPROPANOYL)-L-NORVALINE	C,D,E,X,Y,Z	2FG7	0.71
SN0	N-(3-CARBOXYPROPANOYL)-L-NORVALINE	A	2G6C	0.71
SN0	N-(3-CARBOXYPROPANOYL)-L-NORVALINE	C,D,E,X,Y,Z	2FG6	0.71
1IP	N~2~-(PHOSPHONOACETYL)-L-ASPARAGINE	A,B,C,D	2IPO	0.81
PAO	N-(PHOSPHONOACETYL)-L-ORNITHINE	A,B,C,D,E,F, G,H,I	2OTC	0.77
PAO	N-(PHOSPHONOACETYL)-L-ORNITHINE	A	1OTH	0.77
APO	D-2-AMINO-3-PHOSPHONO-PROPIONIC ACID	A,B	1L8L	0.77
NXA	N-CARBOXYALANINE	A	2IUX	0.8
NXA	N-CARBOXYALANINE	A	1O8A	0.8
IPG	N-ISOPROPYL GLYCINE	C,D	2SEM	0.74