9G8K

Structure of K+-dependent Na+-PPase from Thermotoga maritima in complex with Ca2+ and Etidronate

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, B (A, B)	K(+)-stimulated pyrophosphate-energized sodium pump	polymer	735	78217.1	2	UniProt (Q9S5X0) Pfam (PF03030)	Thermotoga maritima	Membrane-bound sodium-translocating pyrophosphatase,Pyrophosphate-energized inorganic pyrophosphatase,Na(+)-PPase,Tm-PPase
2	C, I (A, B)	(1-hydroxyethane-1,1-diyl)bis(phosphonic acid)	non-polymer		206.0	2	Chemie (911)
3	D, E, F, G, L... (A, B)	MAGNESIUM ION	non-polymer		24.3	9	Chemie (MG)
4	H, Q (A, B)	CALCIUM ION	non-polymer		40.1	2	Chemie (CA)
5	J, K (B)	DODECYL-BETA-D-MALTOSIDE	non-polymer		510.6	2	Chemie (LMT)
6	R, S (A, B)	water	water		18.0	6	Chemie (HOH)

Sequence modifications

A, B: 2 - 726 (UniProt: Q9S5X0)

PDB	External Database	Details
Met -8	-	initiating methionine
Arg -7	-	expression tag
Gly -6	-	expression tag
Ser -5	-	expression tag
His -4	-	expression tag
His -3	-	expression tag
His -2	-	expression tag
His -1	-	expression tag
His 0	-	expression tag
His 1	-	expression tag
Leu 353	Val 353	engineered mutation
Gly 395	Ser 395	engineered mutation

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	156434.3
Non-Polymers*	Number of molecules	15
	Total formula weight	1732.2
All*	Total formula weight	158166.5

*Water molecules are not included.