3WSB

The Tuberculosis Drug SQ109 Inhibits Trypanosoma cruzi Cell Proliferation and acts Synergistically with Posaconazole

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, B, C, D (A, B, C, D)	Farnesyltransferase, putative	polymer	365	41861.8	4	UniProt (Q4CWB4) Pfam (PF00494)	Trypanosoma cruzi
2	E, G, I, K (A, B, C, D)	S-[(2E,6E)-3,7,11-TRIMETHYLDODECA-2,6,10-TRIENYL] TRIHYDROGEN THIODIPHOSPHATE	non-polymer		398.4	4	Chemie (FPS)
3	F, H, J, L (A, B, C, D)	N-[(2Z)-3,7-dimethylocta-2,6-dien-1-yl]-N'-[(1R,3S,5R,7R)-tricyclo[3.3.1.1~3,7~]dec-2-yl]ethane-1,2-diamine	non-polymer		330.6	4	Chemie (RWZ)
4	M, N, O, P (A, B, C, D)	water	water		18.0	433	Chemie (HOH)

Sequence modifications

A, B, C, D: 25 - 368 (UniProt: Q4CWB4)

PDB	External Database	Details
Met 4	-	expression tag
Gly 5	-	expression tag
Ser 6	-	expression tag
Ser 7	-	expression tag
His 8	-	expression tag
His 9	-	expression tag
His 10	-	expression tag
His 11	-	expression tag
His 12	-	expression tag
His 13	-	expression tag
Ser 14	-	expression tag
Ser 15	-	expression tag
Gly 16	-	expression tag
Leu 17	-	expression tag
Val 18	-	expression tag
Pro 19	-	expression tag
Arg 20	-	expression tag
Gly 21	-	expression tag
Ser 22	-	expression tag
His 23	-	expression tag
Met 24	-	expression tag
Glu 82	Asp 82	engineered mutation

Contents of the asymmetric unit

Polymers	Number of chains	4
	Total formula weight	167447.2
Non-Polymers*	Number of molecules	8
	Total formula weight	2915.8
All*	Total formula weight	170363.0

*Water molecules are not included.