MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00945394

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
20E	(2beta,3beta,5beta,22R)-2,3,14,20,22,25- hexahydroxycholest-7-en-6-one	A,D	2R40	0.74
OVA	3,4-DIHYDROXY-2-METHOXY-4-METHYL- 3-[2-METHYL-3-(3-METHYL-BUT-2-ENYL) - OXIRANYL]-CYCLOHEXANONE	A	2GZ5	0.72
OVA	3,4-DIHYDROXY-2-METHOXY-4-METHYL- 3-[2-METHYL-3-(3-METHYL-BUT-2-ENYL) - OXIRANYL]-CYCLOHEXANONE	A	1B59	0.72
GR4		H,I	1AWF	0.7
FUA	FUSIDIC ACID	A	1QCA	0.72
FUA	FUSIDIC ACID	A,B,C,D,E,F, G,H,I,J,K,L	1Q23	0.72
FUA	FUSIDIC ACID	A,B	2VUF	0.72
OCC	2ALPHA-(3-HYDROXYPROPOXY)-1ALPHA,25- DIHYDROXYVITAMIN D3	A	2HAR	0.7
CXT	CARBOXYATRACTYLOSIDE	A	2C3E	0.72
CXT	CARBOXYATRACTYLOSIDE	A	1OKC	0.72
0AS	asiatic acid	A	2QN1	0.7
FOK	FORSKOLIN	A,C	3C16	0.78
FOK	FORSKOLIN	A,C	1CJU	0.78
FOK	FORSKOLIN	A,C	1TL7	0.78
FOK	FORSKOLIN	A,B	1AB8	0.78
FOK	FORSKOLIN	A,C	3C14	0.78
FOK	FORSKOLIN	A,C	1CJT	0.78
FOK	FORSKOLIN	A,B,C	1CUL	0.78
FOK	FORSKOLIN	A,C	1CJV	0.78
FOK	FORSKOLIN	A,C	3C15	0.78
FOK	FORSKOLIN	A,C	1U0H	0.78
FOK	FORSKOLIN	A,B,C	1CS4	0.78
FOK	FORSKOLIN	A,C	1CJK	0.78
NTH	SUCCINIC ACID MONO-(13-METHYL-3- OXO-2,3,6,7,8,9,10,11,12,13,14,15,16,17- TETRADECAHYDRO-1H-CYCLOPENTA[A]PHENANTHREN- 17-YL) ESTER	A,B	1BUQ	0.72
SIM	SIMVASTATIN	A,B,C,D	1HW9	0.7
GA3	GIBBERELLIN A3	A	2ZSH	0.72
GA3	GIBBERELLIN A3	A,B,C,D,E,F	3ED1	0.72
WIN	methyl (5beta,7alpha,9beta,10alpha,11alpha,12alpha,13beta,15alpha)- 15-{[(2E)-3,4-dimethylpent-2-enoyl]oxy}- 3,11,12-trihydroxy-2,16-dioxo-13,20- epoxypicras-3-en-21-oate	0,1,2,3,9,A, B,C,F,H,J,K, L,M,N,O,Q,R, S,T,U,Y,Z	3G71	0.74
GA4	GIBBERELLIN A4	A	2ZSI	0.78
GA4	GIBBERELLIN A4	A,B,C,D,E,F	3EBL	0.78
GA4	GIBBERELLIN A4	H,I	1KFA	0.78
PRB	13-ACETYLPHORBOL	A	1PTR	0.75
P1A	2,3,14,20,22-PENTAHYDROXYCHOLEST- 7-EN-6-ONE	A,D	1R1K	0.74
P1A	2,3,14,20,22-PENTAHYDROXYCHOLEST- 7-EN-6-ONE	E,U	1Z5X	0.74
P1A	2,3,14,20,22-PENTAHYDROXYCHOLEST- 7-EN-6-ONE	E,F,G,H	2NXX	0.74
C3O	2ALPHA-PROPOXY-1ALPHA,25-DIHYDROXYVITAMIN D3	A	2HAS	0.7
TH2	TESTOSTERONE HEMISUCCINATE	A,B	2CBT	0.71
TH2	TESTOSTERONE HEMISUCCINATE	A,B,C,D,E,F	2CBQ	0.71
TH2	TESTOSTERONE HEMISUCCINATE	A	2CBO	0.71
SIH	PROGESTERONE-11-ALPHA-OL-HEMISUCCINATE	H	1DBM	0.73