MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03080652

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
SIC	(2R)-2-[(3S)-3-amino-2,5-dioxopyrrolidin- 1-yl]-3-sulfanylpropanoic acid	A,B	3DIP	0.71
AME	N-ACETYLMETHIONINE	A,B,C,D	1SJA	0.7
AME	N-ACETYLMETHIONINE	A,B	2J4Y	0.7
CDV	3-METHYL-2-UREIDO-BUTYRIC ACID	B	1UF7	0.71
175	3,5-DIHYDRO-5-METHYLIDENE-4H-IMIDAZOL- 4-ON	A,B,C,D,E,F, G,H	1T6P	0.72
175	3,5-DIHYDRO-5-METHYLIDENE-4H-IMIDAZOL- 4-ON	A,B	1T6J	0.72
SAC	N-ACETYL-SERINE	A,B,C,D,F,G, I,J,L,M,N,O, P,Q,S,T,V,W,Z	2EIL	0.75
SAC	N-ACETYL-SERINE	A,B,C,D,F,G, I,J,L,M,N,O, P,Q,S,T,V,W,Z	2DYR	0.75
SAC	N-ACETYL-SERINE	A,B,C,D,F,G, I,J,L,M,N,O, P,S,T,V,W,Z	2EIM	0.75
SAC	N-ACETYL-SERINE	A	1R4U	0.75
SAC	N-ACETYL-SERINE	A,B,C,D	1WS3	0.75
SAC	N-ACETYL-SERINE	A,B,C,D,E,F, G,H	1XY3	0.75
SAC	N-ACETYL-SERINE	A,B	1EVU	0.75
SAC	N-ACETYL-SERINE	A,B,C,D,E,F, G,H	1R56	0.75
SAC	N-ACETYL-SERINE	A,B,C,D,F,G, I,J,L,M,N,O, P,S,T,V,W,Z	2DYS	0.75
SAC	N-ACETYL-SERINE	A	1WRR	0.75
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	0.75
SAC	N-ACETYL-SERINE	A,B	3CVQ	0.75
SAC	N-ACETYL-SERINE	A	1B0B	0.75
SAC	N-ACETYL-SERINE	A	1XT4	0.75
SAC	N-ACETYL-SERINE	A,B,C,F,G,I, J,L,M,N,O,P, S,T,V,W,Z	2EIJ	0.75
SAC	N-ACETYL-SERINE	A	2FXL	0.75
SAC	N-ACETYL-SERINE	A	1R4S	0.75
SAC	N-ACETYL-SERINE	A,B,C,D	1WS2	0.75
SAC	N-ACETYL-SERINE	A,B,C,D	2AUC	0.75
SAC	N-ACETYL-SERINE	A,B,C,D,F,G, I,J,L,M,N,O, P,S,T,V,W,Y,Z	2EIN	0.75
SAC	N-ACETYL-SERINE	A	1R51	0.75
SAC	N-ACETYL-SERINE	A,B,C,E,F,G, I,J,M,N,O,P, Q,S,T,V,W,Z	1V55	0.75
SAC	N-ACETYL-SERINE	A,B,C,D	1XXJ	0.75
SAC	N-ACETYL-SERINE	T	2QAC	0.75
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	0.75
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
NCB	N-CARBAMOYL-ALANINE	A,B,C,D,E,F, G,H,I,J	1QMV	0.75
HIO	N-HYDROXY-N-ISOPROPYLOXAMIC ACID	I,J,K,L	1YVE	0.7
MAA	N-METHYLALANINE	A,B	1A7Z	0.72
MAA	N-METHYLALANINE	A,B	2VSL	0.72
MAA	N-METHYLALANINE	C	1CWI	0.72
MAA	N-METHYLALANINE	C,F,G,H	3DW8	0.72
MAA	N-METHYLALANINE	A,B,C,D,E,F, G,H	2NYL	0.72
MAA	N-METHYLALANINE	D	1D5X	0.72
MAA	N-METHYLALANINE	C	1PYW	0.72
MAA	N-METHYLALANINE	A,B,C,D,E,F, G,H	2NYM	0.72
MAA	N-METHYLALANINE	C,I	2IE3	0.72
MAA	N-METHYLALANINE	C,F,X,Y	2NPP	0.72
NLQ	N~2~-ACETYL-L-GLUTAMINE	A,B,C,D	2GGH	0.71
NLQ	N~2~-ACETYL-L-GLUTAMINE	A,B,C,D	1XPY	0.71
I38	N-(3-MERCAPTOPROPANOYL)-D-ALANINE	A	2QDT	0.75
DLS	DI-ACETYL-LYSINE	A,B,C,D,E,F	1FVM	0.71
PAL	N-(PHOSPHONACETYL)-L-ASPARTIC ACID	A,B,C	1EKX	0.73
PAL	N-(PHOSPHONACETYL)-L-ASPARTIC ACID	A,B,C,D,E,F, G,H,I,J,K,L	1Q95	0.73
PAL	N-(PHOSPHONACETYL)-L-ASPARTIC ACID	A,B,C,D	1TTH	0.73
PAL	N-(PHOSPHONACETYL)-L-ASPARTIC ACID	A,B,C,D	1ACM	0.73
PAL	N-(PHOSPHONACETYL)-L-ASPARTIC ACID	A,B,C,D	1D09	0.73
PAL	N-(PHOSPHONACETYL)-L-ASPARTIC ACID	A,B,C,D	1XJW	0.73
PAL	N-(PHOSPHONACETYL)-L-ASPARTIC ACID	A	1ML4	0.73
PAL	N-(PHOSPHONACETYL)-L-ASPARTIC ACID	B,D	1I5O	0.73
PAL	N-(PHOSPHONACETYL)-L-ASPARTIC ACID	A,B,C,D	1F1B	0.73
PAL	N-(PHOSPHONACETYL)-L-ASPARTIC ACID	A,B,C,D	8ATC	0.73
NCD	N-CARBAMOYL-L-ASPARTATE	A,B	2Z26	0.77
NCD	N-CARBAMOYL-L-ASPARTATE	A,B	1J79	0.77
NCD	N-CARBAMOYL-L-ASPARTATE	A,B	1XGE	0.77
NCD	N-CARBAMOYL-L-ASPARTATE	A,B	2Z29	0.77
NCD	N-CARBAMOYL-L-ASPARTATE	A,B,G,H	1R0C	0.77
NCD	N-CARBAMOYL-L-ASPARTATE	A,B	2Z27	0.77
NCD	N-CARBAMOYL-L-ASPARTATE	A,B	2Z28	0.77
NCD	N-CARBAMOYL-L-ASPARTATE	A,B	2Z2A	0.77
NCD	N-CARBAMOYL-L-ASPARTATE	A,B	2Z24	0.77
NCD	N-CARBAMOYL-L-ASPARTATE	A,B	2Z25	0.77
SC2	N-ACETYL-L-CYSTEINE	A,B,C,D,E,F, G,H	2J58	0.73
SC2	N-ACETYL-L-CYSTEINE	A,B,C,D,E,F	2J2P	0.73
SC2	N-ACETYL-L-CYSTEINE	B,C,D,E,F	2J1G	0.73
REX	GLYCYL-L-ALPHA-AMINO-EPSILON-PIMELYL- D-ALANYL-D-ALANINE	A	1IKG	0.7
IPG	N-ISOPROPYL GLYCINE	C,D	2SEM	0.7
URP	N-(AMINOCARBONYL)-BETA-ALANINE	A,B,C,D	2V8V	0.71
URP	N-(AMINOCARBONYL)-BETA-ALANINE	A,B,C,D	2FVM	0.71
URP	N-(AMINOCARBONYL)-BETA-ALANINE	A,B,C,D	2V8H	0.71
6PR	(S)-4-AMINO-4-OXO-3-(2-PHOSPHONOACETAMIDO)BUTANOIC ACID	A,B,C,D	2H3E	0.73
OGA	N-OXALYOLGLYCINE	A,B,C,D	2OQ6	0.75
OGA	N-OXALYOLGLYCINE	A	2RDS	0.75
OGA	N-OXALYOLGLYCINE	A	1H2M	0.75
OGA	N-OXALYOLGLYCINE	A	2QRL	0.75
OGA	N-OXALYOLGLYCINE	A,B,C,D	2OX0	0.75
OGA	N-OXALYOLGLYCINE	A	2RDR	0.75
OGA	N-OXALYOLGLYCINE	A,B,C,D	2OS2	0.75
OGA	N-OXALYOLGLYCINE	A,B,I,J	2PXJ	0.75
OGA	N-OXALYOLGLYCINE	A,B,F,G	2Q8E	0.75
OGA	N-OXALYOLGLYCINE	A,B,I,J	2P5B	0.75
OGA	N-OXALYOLGLYCINE	A	1H2K	0.75
OGA	N-OXALYOLGLYCINE	A,B,C,D	2OT7	0.75
OGA	N-OXALYOLGLYCINE	A,B	2OQ7	0.75
193	(2S)-4-(BETA-ALANYLAMINO)-2-AMINOBUTANOIC ACID	A	1XY5	0.76
AN0	N-ACETYL-L-NORVALINE	C,D,E,X,Y,Z	2G7M	0.75
AN0	N-ACETYL-L-NORVALINE	A	1ZQ8	0.75
NXA	N-CARBOXYALANINE	A	2IUX	0.76
NXA	N-CARBOXYALANINE	A	1O8A	0.76
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
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	0.71
SUI	(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID	A,B	1OEX	0.76
SUI	(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID	A	2OWX	0.76
SUI	(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID	A,I	1GVW	0.76
SUI	(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID	A,I	1GVX	0.76
SUI	(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID	A	2OWW	0.76
SUI	(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID	A,B	1GKT	0.76
SUI	(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID	A	2OWC	0.76
SUI	(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID	A,I	1GVV	0.76
SUI	(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID	A,I	1GVT	0.76
SUI	(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID	A,B	2VS2	0.76
SUI	(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID	A	1OEW	0.76
SUI	(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID	A,I	1GVU	0.76
SUI	(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID	A,B	2JJJ	0.76
SUI	(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID	A,B	2JJI	0.76
AOR	N~2~-ACETYL-L-ORNITHINE	A	1ZQ6	0.73
AAC	ACETYLAMINO-ACETIC ACID	A,B	1NG3	0.7
AAC	ACETYLAMINO-ACETIC ACID	A	1QD8	0.7
AYA	N-ACETYLALANINE	A	1D0W	0.81
AYA	N-ACETYLALANINE	A	1AH4	0.81
AYA	N-ACETYLALANINE	A,B	1VBP	0.81
AYA	N-ACETYLALANINE	A,B,C,D,E,F, G,H	1J4T	0.81
AYA	N-ACETYLALANINE	A,B,C,D	1OUW	0.81
AYA	N-ACETYLALANINE	A	1AH3	0.81
AYA	N-ACETYLALANINE	A	1EKO	0.81
AYA	N-ACETYLALANINE	B,D,F,H	2V4I	0.81
AYA	N-ACETYLALANINE	A,B,C,D,E,F, G,H	1VBO	0.81
AYA	N-ACETYLALANINE	A,B,C,D	1J4U	0.81
CLG	2-AMINO-6-[2-(2-AMINOOXY-ACETYLAMINO)- ACETYLAMINO]-HEXANOIC ACID	A,B	1K09	0.74
REY	GLYCYL-L-ALPHA-AMINO-EPSILON-PIMELYL- D-ALANINE	A	1IKI	0.71
MHA	(CARBAMOYLMETHYL-CARBOXYMETHYL- AMINO)-ACETIC ACID	A,B	2IXX	0.72
MHA	(CARBAMOYLMETHYL-CARBOXYMETHYL- AMINO)-ACETIC ACID	A,B	1IX1	0.72