3CP6

Crystal structure of human farnesyl diphosphate synthase (T201A mutant) complexed with Mg and biphosphonate inhibitor

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A (A)	Farnesyl pyrophosphate synthetase	polymer	376	43246.2	1	UniProt (P14324) Pfam (PF00348)	Homo sapiens (human)	(FPP synthetase) (FPS) (Farnesyl diphosphate synthetase) [Includes: Dimethylallyltranstransferase (EC 2.5.1.1); Geranyltranstransferase (EC 2.5.1.10)]
2	B, C, D (A)	MAGNESIUM ION	non-polymer		24.3	3	Chemie (MG)
3	E (A)	(4aS,7aR)-octahydro-1H-cyclopenta[b]pyridine-6,6-diylbis(phosphonic acid)	non-polymer		285.2	1	Chemie (RSX)
4	F (A)	water	water		18.0	210	Chemie (HOH)

Sequence modifications

A: 1 - 353 (UniProt: P14324)

PDB	External Database	Details
Met -22	-	expression tag
Gly -21	-	expression tag
Ser -20	-	expression tag
Ser -19	-	expression tag
His -18	-	expression tag
His -17	-	expression tag
His -16	-	expression tag
His -15	-	expression tag
His -14	-	expression tag
His -13	-	expression tag
Ser -12	-	expression tag
Ser -11	-	expression tag
Gly -10	-	expression tag
Arg -9	-	expression tag
Glu -8	-	expression tag
Asn -7	-	expression tag
Leu -6	-	expression tag
Tyr -5	-	expression tag
Phe -4	-	expression tag
Gln -3	-	expression tag
Gly -2	-	expression tag
His -1	-	expression tag
Met 0	-	expression tag
Ala 201	Thr 201	engineered mutation

Contents of the asymmetric unit

Polymers	Number of chains	1
	Total formula weight	43246.2
Non-Polymers*	Number of molecules	4
	Total formula weight	358.1
All*	Total formula weight	43604.2

*Water molecules are not included.