9K6X

Structural and functional basis of antinociceptive action of conotoxin AoIA at the noradrenaline transporter

This is a non-PDB format compatible entry.

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, D (C, D)	conotoxin AoIA	polymer	11	1319.6	2		Conus marmoreus
2	B, C (A, B)	Sodium-dependent noradrenaline transporter	polymer	629	70715.9	2	UniProt (P23975) Pfam (PF00209)	Homo sapiens (human)	Norepinephrine transporter,NET,Solute carrier family 6 member 2
3	E, S (A, B)	[(2~{R})-3-[[(2~{S})-2,3-bis(oxidanyl)propoxy]-oxidanyl-phosphoryl]oxy-2-oxidanyl-propyl] (9~{Z},12~{Z})-octadeca-9,12-dienoate	non-polymer		508.6	2	Chemie (A1EET)
4	F, G, T, U (A, B)	SODIUM ION	non-polymer		23.0	4	Chemie (NA) PubChem (923)
5	H, V (A, B)	CHLORIDE ION	non-polymer		35.5	2	Chemie (CL) PubChem (312)
6	I, J, K, L, M... (A, B)	CHOLESTEROL	non-polymer		386.7	14	Chemie (CLR) PubChem (5997)

Sequence modifications

A, B: 1 - 617 (UniProt: P23975)

PDB	External Database	Details
Met -11	-	initiating methionine
Asp -10	-	expression tag
Tyr -9	-	expression tag
Lys -8	-	expression tag
Asp -7	-	expression tag
Asp -6	-	expression tag
Asp -5	-	expression tag
Asp -4	-	expression tag
Lys -3	-	expression tag
Gly -2	-	expression tag
Ser -1	-	expression tag
Gly 0	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	4
	Total formula weight	144071.0
Non-Polymers*	Number of molecules	22
	Total formula weight	6593.2
All*	Total formula weight	150664.2

*Water molecules are not included.