MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02300824

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
2AS	(2S,3S)-3-amino-2-methyl-4-oxobutanoic acid	A,B,C,D,E,F, G,H,I,J,K,L	1W3M	0.71
ASI	L-ISO-ASPARTATE	A	1EJC	0.75
ASI	L-ISO-ASPARTATE	A,B	1EJD	0.75
ASI	L-ISO-ASPARTATE	A,B,C,D	1YBG	0.75
ASI	L-ISO-ASPARTATE	A,B,C,D,E,F, G,H	1RYW	0.75
ASI	L-ISO-ASPARTATE	A,B,C,D	2Z2C	0.75
ASI	L-ISO-ASPARTATE	A,B,C,D	1JG3	0.75
ASI	L-ISO-ASPARTATE	A,B	1DLG	0.75
ASI	L-ISO-ASPARTATE	A,B,C,D	2HSE	0.75
ASI	L-ISO-ASPARTATE	A	1EYN	0.75
ASI	L-ISO-ASPARTATE	A	2JV0	0.75
ASI	L-ISO-ASPARTATE	A,B,C,D,E,F, G,H,I,J,K,L, W,X,Y,Z	1Q3G	0.75
OHS	O-(CARBOXYSULFANYL)-4-OXO-L-HOMOSERINE	A,C	1Y9A	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
3MD	2S,3S-3-METHYLASPARTIC ACID	A,B	1KKR	0.71
3MD	2S,3S-3-METHYLASPARTIC ACID	A,B,C,D	1I9C	0.71
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
IAS	BETA-ASPARTYL RESIDUE (GAMMA-LINKED)	A	1RTU	0.75
IAS	BETA-ASPARTYL RESIDUE (GAMMA-LINKED)	A	1AT6	0.75
IAS	BETA-ASPARTYL RESIDUE (GAMMA-LINKED)	E,I	2FTL	0.75
IAS	BETA-ASPARTYL RESIDUE (GAMMA-LINKED)	A,B	1DY5	0.75
IAS	BETA-ASPARTYL RESIDUE (GAMMA-LINKED)	A,B	2FTM	0.75
IAS	BETA-ASPARTYL RESIDUE (GAMMA-LINKED)	E,I	2FI4	0.75
IAS	BETA-ASPARTYL RESIDUE (GAMMA-LINKED)	E,I	2FI5	0.75
IAS	BETA-ASPARTYL RESIDUE (GAMMA-LINKED)	A	1C9P	0.75
IAS	BETA-ASPARTYL RESIDUE (GAMMA-LINKED)	A,B	1LSQ	0.75
DAS	D-ASPARTIC ACID	A	1BFW	0.75
DAS	D-ASPARTIC ACID	A,B,C,H,K,L	2R5D	0.75
DAS	D-ASPARTIC ACID	A	1KS7	0.75
DAS	D-ASPARTIC ACID	A	1C4B	0.75
DAS	D-ASPARTIC ACID	A,B,C,D	3BOG	0.75
DAS	D-ASPARTIC ACID	A,L	1ZEA	0.75
DAS	D-ASPARTIC ACID	A,B,C,D	1HG1	0.75
DAS	D-ASPARTIC ACID	A,B,C,H,K,L	2R5B	0.75
DAS	D-ASPARTIC ACID	A,B	2Q33	0.75
DAS	D-ASPARTIC ACID	E	1AN1	0.75
0AK	(2S)-2-amino-4-(2-chloroethoxy)- 4-oxobutanoic acid	A	2DHD	0.78
ACB	3-METHYL-ASPARTIC ACID	C,F,G,H	3DW8	0.71
ACB	3-METHYL-ASPARTIC ACID	A,B,C,D,E,F, G,H	2NYL	0.71
ACB	3-METHYL-ASPARTIC ACID	A	1EVD	0.71
ACB	3-METHYL-ASPARTIC ACID	A	1EVB	0.71
ACB	3-METHYL-ASPARTIC ACID	A	1EVA	0.71
ACB	3-METHYL-ASPARTIC ACID	A	1LCM	0.71
ACB	3-METHYL-ASPARTIC ACID	A,B,C,D,E,F, G,H	2NYM	0.71
ACB	3-METHYL-ASPARTIC ACID	A	1AY3	0.71
ACB	3-METHYL-ASPARTIC ACID	A,B,M,N	1FJM	0.71
ACB	3-METHYL-ASPARTIC ACID	C,I	2IE3	0.71
ACB	3-METHYL-ASPARTIC ACID	C,F,X,Y	2NPP	0.71
ACB	3-METHYL-ASPARTIC ACID	C,F,M,N	2IAE	0.71
ACB	3-METHYL-ASPARTIC ACID	A	1EVC	0.71
BFD	ASPARTATE BERYLLIUM TRIFLUORIDE	A	2JCM	0.72
BFD	ASPARTATE BERYLLIUM TRIFLUORIDE	A,B	1J97	0.72
BFD	ASPARTATE BERYLLIUM TRIFLUORIDE	A,B	2G07	0.72
BFD	ASPARTATE BERYLLIUM TRIFLUORIDE	A	1TA0	0.72
BFD	ASPARTATE BERYLLIUM TRIFLUORIDE	A,B,C,D	1RLO	0.72
BFD	ASPARTATE BERYLLIUM TRIFLUORIDE	A,B	1ZDM	0.72
BFD	ASPARTATE BERYLLIUM TRIFLUORIDE	A	3EF1	0.72
BFD	ASPARTATE BERYLLIUM TRIFLUORIDE	E,F,G,H	2FTK	0.72
BFD	ASPARTATE BERYLLIUM TRIFLUORIDE	A,B	2HEG	0.72
MVA	N-METHYLVALINE	A	209D	0.71
MVA	N-METHYLVALINE	A,B,C,D,E,F, G,H	3BO7	0.71
MVA	N-METHYLVALINE	C	1CWH	0.71
MVA	N-METHYLVALINE	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	0.71
MVA	N-METHYLVALINE	A	1DSD	0.71
MVA	N-METHYLVALINE	B	1L1V	0.71
MVA	N-METHYLVALINE	A,B,C,D,E,F, I,J,K,L,M,N	2ESL	0.71
MVA	N-METHYLVALINE	B,D,F,H,J,L, N,P,R,T	2RMB	0.71
MVA	N-METHYLVALINE	C	1CWO	0.71
MVA	N-METHYLVALINE	C	1CWL	0.71
MVA	N-METHYLVALINE	B	1MIK	0.71
MVA	N-METHYLVALINE	A	1CSA	0.71
MVA	N-METHYLVALINE	C	1CWM	0.71
MVA	N-METHYLVALINE	A	1PFE	0.71
MVA	N-METHYLVALINE	A,B,D,E,F,H	1M63	0.71
MVA	N-METHYLVALINE	C	1CWC	0.71
MVA	N-METHYLVALINE	B,D,F,H	2RMC	0.71
MVA	N-METHYLVALINE	C	1CWK	0.71
MVA	N-METHYLVALINE	C	1CYN	0.71
MVA	N-METHYLVALINE	C,D	1MNV	0.71
MVA	N-METHYLVALINE	C,D	2OJU	0.71
MVA	N-METHYLVALINE	B,D,F,H,J,L, N,P,R,T	2RMA	0.71
MVA	N-METHYLVALINE	A	1CYB	0.71
MVA	N-METHYLVALINE	D	1QNG	0.71
MVA	N-METHYLVALINE	A,C,E,G	2ADW	0.71
MVA	N-METHYLVALINE	C	1CWB	0.71
MVA	N-METHYLVALINE	A,B,C,D,E,F	1UNM	0.71
MVA	N-METHYLVALINE	A,B	1OVF	0.71
MVA	N-METHYLVALINE	A,B	185D	0.71
MVA	N-METHYLVALINE	A	1XVK	0.71
MVA	N-METHYLVALINE	A,C	1XVR	0.71
MVA	N-METHYLVALINE	A,B	173D	0.71
MVA	N-METHYLVALINE	A,B	1FJA	0.71
MVA	N-METHYLVALINE	B	3CYS	0.71
MVA	N-METHYLVALINE	A,B,C	1A7Y	0.71
MVA	N-METHYLVALINE	A,B,C	1L5G	0.71
MVA	N-METHYLVALINE	A,B,C,D	1I3W	0.71
MVA	N-METHYLVALINE	A	316D	0.71
MVA	N-METHYLVALINE	A	1XVN	0.71
MVA	N-METHYLVALINE	C	1IKF	0.71
MVA	N-METHYLVALINE	A,M,N	2Z6W	0.71
MVA	N-METHYLVALINE	A,B,C	1QFI	0.71
MVA	N-METHYLVALINE	A,B	3GO3	0.71
MVA	N-METHYLVALINE	C	1CWA	0.71
MVA	N-METHYLVALINE	C	1CWF	0.71
MVA	N-METHYLVALINE	B,D,F,H,J,L, N,P	1C5F	0.71
MVA	N-METHYLVALINE	D,E,F	1XQ7	0.71
MVA	N-METHYLVALINE	A	1CYA	0.71
MVA	N-METHYLVALINE	A,B,D	1MF8	0.71
MVA	N-METHYLVALINE	A,B	1A7Z	0.71
MVA	N-METHYLVALINE	A	1DSC	0.71
MVA	N-METHYLVALINE	T,U,V	2POY	0.71
MVA	N-METHYLVALINE	A	2D55	0.71
MVA	N-METHYLVALINE	C	1BCK	0.71
MVA	N-METHYLVALINE	C	1CWI	0.71
MVA	N-METHYLVALINE	C,D	1QNH	0.71
MVA	N-METHYLVALINE	A	1VS2	0.71