MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02383968

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
MNB	5-MERCAPTO-2-NITRO-BENZOIC ACID	A	1F42	0.72
MNB	5-MERCAPTO-2-NITRO-BENZOIC ACID	A	1RXE	0.72
MNB	5-MERCAPTO-2-NITRO-BENZOIC ACID	A	2PER	0.72
AHC	4-AMINOHYDROCINNAMIC ACID	A,B	2AY1	0.72
KYN	KYNURENINE	A,B,C,D	2R2N	0.71
KYN	KYNURENINE	A,B	3E2Z	0.71
KYN	KYNURENINE	A	1XT7	0.71
KYN	KYNURENINE	A	1T5M	0.71
KYN	KYNURENINE	A	1T5N	0.71
KYN	KYNURENINE	A	2VOV	0.71
KYN	KYNURENINE	A	2VOX	0.71
TNL	2,4,6-TRINITROTOLUENE	A	1GVR	0.71
AAN	2-(4-NITROPHENYL)ACETIC ACID	B	1AJN	0.8
MNP	2-(3-NITROPHENYL)ACETIC ACID	B	1AI5	0.79
4NM	4-NITROPHENYL METHANETHIOL	A,B	2VO4	0.72
NPA	2-(4-HYDROXY-3-NITROPHENYL)ACETIC ACID	H	1NGP	0.7
BVA	TRIHYDROXY[(N-HYDROXYBENZAMIDATO)OXO]VANADATE	B,C	2P8O	0.72
3AB	3-aminobenzamide	A,B,C,D	3GOY	0.78
PRQ	(3S)-3-amino-3-(2-nitrophenyl)propanoic acid	C,F,I,L	2VE6	0.72
NTD	2-{HYDROXY[2-NITRO-4-(TRIFLUOROMETHYL)PHENYL]METHYLENE}CYCLOHEXANE- 1,3-DIONE	A,B	1T47	0.75
CRI		A,B	1VKG	0.7
BHO	BENZHYDROXAMIC ACID	A,B	1GX2	0.72
BHO	BENZHYDROXAMIC ACID	A	1HSR	0.72
BHO	BENZHYDROXAMIC ACID	A,B	2ATJ	0.72
BHO	BENZHYDROXAMIC ACID	A,B	4ATJ	0.72
BHO	BENZHYDROXAMIC ACID	A,B	3ATJ	0.72
BHO	BENZHYDROXAMIC ACID	A	3GCK	0.72
BHO	BENZHYDROXAMIC ACID	A,B,C,D,E,F, G,H	2BOY	0.72
53N	3-[5-(3-nitrophenyl)thiophen-2- yl]propanoic acid	A	3DN5	0.71
TSN	TRICHOSTATIN A	A,B	1T64	0.74
TSN	TRICHOSTATIN A	A,B	1C3R	0.74
TSN	TRICHOSTATIN A	A,B,C	3F0R	0.74
TSN	TRICHOSTATIN A	A,B,C	3C10	0.74
GAB	3-AMINOBENZOIC ACID	A,B,C,D,E,F	2PQF	0.72
GAB	3-AMINOBENZOIC ACID	A,B	3GSB	0.72
GAB	3-AMINOBENZOIC ACID	A,B,C	1GBN	0.72
GAB	3-AMINOBENZOIC ACID	A	3FHB	0.72
NID	4-NITRO-INDEN-1-ONE	A,B	1DOH	0.88
GW9	2-chloro-5-nitro-N-phenylbenzamide	A,D	3E00	0.71
PNZ	P-NITRO-BENZYLAMINE	A,D,H	2HJ4	0.71
PNZ	P-NITRO-BENZYLAMINE	A,B	2C70	0.71
KY1	4-(2-AMINOPHENYL)-4-OXOBUTANOIC ACID	A,B,C,D	2CH2	0.75
PPN	PARA-NITROPHENYLALANINE	I	1YTJ	0.75
4NB	4-NITROBENZOIC ACID	A,B	3CHT	0.77
3NT	3-NITROTOLUENE	A,B	2BMR	0.76
3NT	3-NITROTOLUENE	A,B	2HMO	0.76