MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00011577

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
DCL	2-AMINO-4-METHYL-PENTAN-1-OL	A	1FFF	0.72
DCL	2-AMINO-4-METHYL-PENTAN-1-OL	A,B	1EBK	0.72
DCL	2-AMINO-4-METHYL-PENTAN-1-OL	I	1DS3	0.72
DCL	2-AMINO-4-METHYL-PENTAN-1-OL	C	1K2B	0.72
DCL	2-AMINO-4-METHYL-PENTAN-1-OL	C	1K2C	0.72
DCL	2-AMINO-4-METHYL-PENTAN-1-OL	A,B,C	2AOE	0.72
DCL	2-AMINO-4-METHYL-PENTAN-1-OL	A	1FG8	0.72
DCL	2-AMINO-4-METHYL-PENTAN-1-OL	A	1DW6	0.72
DCL	2-AMINO-4-METHYL-PENTAN-1-OL	C,D	2R9B	0.72
DCL	2-AMINO-4-METHYL-PENTAN-1-OL	B,C	1K1T	0.72
DCL	2-AMINO-4-METHYL-PENTAN-1-OL	A,B	1DAZ	0.72
DCL	2-AMINO-4-METHYL-PENTAN-1-OL	C	1K1U	0.72
ALO	ALLO-THREONINE	I,P	1HDT	0.85
ALO	ALLO-THREONINE	A	2JUU	0.85
ALO	ALLO-THREONINE	A	2VMX	0.85
DIL	D-ISOLEUCINE	A,B	2Q33	0.81
DIL	D-ISOLEUCINE	A	1CWZ	0.81
DIL	D-ISOLEUCINE	A	1CVQ	0.81
DIL	D-ISOLEUCINE	A	1C4B	0.81
DIL	D-ISOLEUCINE	A	1CW8	0.81
DIL	D-ISOLEUCINE	A	2AP8	0.81
CTH	4-CHLOROTHREONINE	A,B	1A7Z	0.72
BIL	(3R,4S)-3-amino-4-methylhexanoic acid	A,B,C	3HEZ	0.73
BIL	(3R,4S)-3-amino-4-methylhexanoic acid	A,B,C,D	3C3F	0.73
BIL	(3R,4S)-3-amino-4-methylhexanoic acid	A	3HF0	0.73
BIL	(3R,4S)-3-amino-4-methylhexanoic acid	A	3C3G	0.73
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A	1Q8H	0.78
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	H,L	1WV7	0.78
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	H,L	2EC9	0.78
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A,H,L,U	2C4F	0.78
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A	2DPQ	0.78
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	L	1PFX	0.78
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	H,L	1Z6J	0.78
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A	1AG7	0.78
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	C,H,L,T	2FIR	0.78
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A	1ONU	0.78
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	H,L	2ZZU	0.78
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	H,L	1W2K	0.78
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	H,L	1WTG	0.78
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A,B,C	1TGG	0.78
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	H,I,L,T	2B8O	0.78
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A	1NL1	0.78
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	H,L	1WQV	0.78
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A	2PF2	0.78
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A	1WHE	0.78
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	H,L	1WUN	0.78
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	H,L,T	2AER	0.78
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A	1ONT	0.78
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A	1WCT	0.78
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A,B,G	1IOD	0.78
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	H,L	1W0Y	0.78
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A	1AWY	0.78
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	C,H,L	1DAN	0.78
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A,B,C	1VZM	0.78
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	H,L	2AEI	0.78
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	G,L	1NL0	0.78
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A	1AD7	0.78
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	H,L	2ZP0	0.78
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A	1Q3M	0.78
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A,B,C	1J35	0.78
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	H,L	1P0S	0.78
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A	1WHF	0.78
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	H,L	2ZWL	0.78
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A	1CFI	0.78
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A	2O6N	0.78
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A	1MTQ	0.78
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	H,L,T	2A2Q	0.78
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A,B,C	1J34	0.78
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	H,L	1WSS	0.78
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A,B,C,D	1LQV	0.78
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A	1MGX	0.78
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A,B	2DPR	0.78
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A	2SPT	0.78
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A	1NL2	0.78
DLE	D-LEUCINE	A,B	1ALZ	0.85
DLE	D-LEUCINE	A,B	1BDW	0.85
DLE	D-LEUCINE	A,D	1CZQ	0.85
DLE	D-LEUCINE	A	1BFW	0.85
DLE	D-LEUCINE	E,F,G,H	1XN2	0.85
DLE	D-LEUCINE	A,B,C,D	1GMK	0.85
DLE	D-LEUCINE	A,B	1TKQ	0.85
DLE	D-LEUCINE	A,B,C,H,K,L	2R5D	0.85
DLE	D-LEUCINE	A	2NPV	0.85
DLE	D-LEUCINE	A,B,C,D	2R3C	0.85
DLE	D-LEUCINE	B,D,E	1AFQ	0.85
DLE	D-LEUCINE	A,B	1MIC	0.85
DLE	D-LEUCINE	A,B	1NRU	0.85
DLE	D-LEUCINE	A,B	1JNO	0.85
DLE	D-LEUCINE	A,B	1GRM	0.85
DLE	D-LEUCINE	A,B	1NRM	0.85
DLE	D-LEUCINE	A,D	2Q3I	0.85
DLE	D-LEUCINE	A,B	1NT5	0.85
DLE	D-LEUCINE	A	2JUE	0.85
DLE	D-LEUCINE	A,B,C,D	1AV2	0.85
DLE	D-LEUCINE	A	1YY2	0.85
DLE	D-LEUCINE	A,B	1AL4	0.85
DLE	D-LEUCINE	A,B	1NG8	0.85
DLE	D-LEUCINE	A,B	1ALX	0.85
DLE	D-LEUCINE	A,B	1JO4	0.85
DLE	D-LEUCINE	A,B,C,H,K,L	2R5B	0.85
DLE	D-LEUCINE	A,B	1MAG	0.85
DLE	D-LEUCINE	A,B	1NT6	0.85
DLE	D-LEUCINE	A,B	2Q33	0.85
DLE	D-LEUCINE	A,B	1JO3	0.85
DLE	D-LEUCINE	E,I	1BLL	0.85
DLE	D-LEUCINE	A,B	1KQE	0.85
DLE	D-LEUCINE	A,B,C,D	1W5U	0.85
DLE	D-LEUCINE	A,B,C,D	2IZQ	0.85
DLE	D-LEUCINE	A	1C4B	0.85
DLE	D-LEUCINE	A,B,C,D	1C4D	0.85
DFO	2,2-DIFLUORO-3-HYDROSTATINE	E,I	1APV	0.71
CHS	4-AMINO-5-CYCLOHEXYL-3-HYDROXY- PENTANOIC ACID	I	1E80	0.74
CHS	4-AMINO-5-CYCLOHEXYL-3-HYDROXY- PENTANOIC ACID	I	1EED	0.74
CHS	4-AMINO-5-CYCLOHEXYL-3-HYDROXY- PENTANOIC ACID	I	2ER0	0.74
DFI	2,2-DIFLUOROSTATINE	E,I	1APW	0.78
D11	D-PHOSPHOTHREONINE	A,B	2ITK	0.73
AA4	2-AMINO-5-HYDROXYPENTANOIC ACID	B	1MIK	0.77
AA4	2-AMINO-5-HYDROXYPENTANOIC ACID	E,I	1QR3	0.77
DSE	N-METHYL-D-SERINE	C	1CWH	0.71
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
DNE	D-NORLEUCINE	A	1R9V	0.72
DNE	D-NORLEUCINE	A,B	1S4A	0.72
DNE	D-NORLEUCINE	A,B	1S1O	0.72
DSN	D-SERINE	A	1XVN	0.72
DSN	D-SERINE	A	2IGZ	0.72
DSN	D-SERINE	A,B,C,D	2R3C	0.72
DSN	D-SERINE	A	1BFW	0.72
DSN	D-SERINE	A,B,C	2W16	0.72
DSN	D-SERINE	A,B	185D	0.72
DSN	D-SERINE	A,B,C,D	3BOG	0.72
DSN	D-SERINE	A	1XVK	0.72
DSN	D-SERINE	A,C	1XVR	0.72
DSN	D-SERINE	A,L	1ZEA	0.72
DSN	D-SERINE	A,B,C,D	1UHG	0.72
DSN	D-SERINE	A	1T5M	0.72
DSN	D-SERINE	C,D	193D	0.72
DSN	D-SERINE	A	2V3U	0.72
DSN	D-SERINE	A,B	3GO3	0.72
DSN	D-SERINE	A,B	2RCB	0.72
DSN	D-SERINE	A	1T5N	0.72
DSN	D-SERINE	B	2HH4	0.72
DSN	D-SERINE	A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P	1YWH	0.72
DSN	D-SERINE	A,B,C	2UZP	0.72
DSN	D-SERINE	A	1TD4	0.72
DSN	D-SERINE	A	1PB8	0.72
DSN	D-SERINE	A	1PFE	0.72
DSN	D-SERINE	A,B	2DA8	0.72
DSN	D-SERINE	A	2JUE	0.72
DSN	D-SERINE	A	1XT7	0.72
DSN	D-SERINE	A	2IH0	0.72
DSN	D-SERINE	A,B	2RC8	0.72
DSN	D-SERINE	A,B	2Q33	0.72
B3L	(3S)-3-amino-5-methylhexanoic acid	A	3C3H	0.73
B3L	(3S)-3-amino-5-methylhexanoic acid	A	3C3G	0.73
B3L	(3S)-3-amino-5-methylhexanoic acid	A,B,C,D	3C3F	0.73
B3L	(3S)-3-amino-5-methylhexanoic acid	A,B,C	3HEZ	0.73
B3L	(3S)-3-amino-5-methylhexanoic acid	A,B,D,E,F	3FDM	0.73
BIU	5-bromo-L-isoleucine	A	3EDS	0.75
2ML	2-METHYLLEUCINE	A,B,C	1I1L	0.76
2ML	2-METHYLLEUCINE	A	2RM9	0.76
2ML	2-METHYLLEUCINE	A	2RMD	0.76
DDO	6-HYDROXY-D-NORLEUCINE	A,B,C,D	1JSL	0.73