2RAH

Human FDPS synthase in complex with novel inhibitor

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A	Farnesyl pyrophosphate synthetase	polymer	378	43471.4	1	UniProt (P14324) Pfam (PF00348) In PDB	Homo sapiens (human)	FPP synthetase, FPS, Farnesyl diphosphate synthetase
2	A	MAGNESIUM ION	non-polymer		24.3	1	Chemie (MG)
3	A	SULFATE ION	non-polymer		96.1	1	Chemie (SO4)
4	A	[(7R)-6,7-dihydro-5H-cyclopenta[c]pyridin-7-yl(hydroxy)methylene]bis(phosphonic acid)	non-polymer		309.1	1	Chemie (11P)
5		water	water		18.0	113	Chemie (HOH)

Sequence modifications

A: 1 - 353 (UniProt: P14324)

PDB	External Database	Details
Met -24	-	expression tag
Gly -23	-	expression tag
Ser -22	-	expression tag
Ser -21	-	expression tag
His -20	-	expression tag
His -19	-	expression tag
His -18	-	expression tag
His -17	-	expression tag
His -16	-	expression tag
His -15	-	expression tag
Ser -14	-	expression tag
Ser -13	-	expression tag
Gly -12	-	expression tag
Arg -11	-	expression tag
Glu -10	-	expression tag
Asn -9	-	expression tag
Leu -8	-	expression tag
Tyr -7	-	expression tag
Phe -6	-	expression tag
Gln -5	-	expression tag
Gly -4	-	expression tag
His -3	-	expression tag
Met -2	-	expression tag
Gly -1	-	expression tag
His 0	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	1
	Total formula weight	43471.4
Non-Polymers*	Number of molecules	3
	Total formula weight	429.5
All*	Total formula weight	43900.9

*Water molecules are not included.