9W63

Cryo-EM structure of C20:5-CoA bound state human ABCD3 in inward-facing conformation

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A (A)	Isoform 1 of ATP-binding cassette sub-family D member 3,Green fluorescent protein	polymer	914	104527.6	1	UniProt (P28288) UniProt (P42212)	Homo sapiens (human)	70 kDa peroxisomal membrane protein,PMP70
2	B (A)	S-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-oxidanyl-3-phosphonooxy-oxolan-2-yl]methoxy-oxidanyl-phosphoryl]oxy-oxidanyl-phosphoryl]oxy-3,3-dimethyl-2-oxidanyl-butanoyl]amino]propanoylamino]ethyl] (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenethioate	non-polymer		1054.0	1	Chemie (3IX)
3	C, D, E, F, G (A)	CHOLESTEROL	non-polymer		386.7	5	Chemie (CLR) PubChem (5997)

Sequence modifications

A: 1 - 659 (UniProt: P28288)

PDB	External Database	Details
Leu 660	-	linker
Glu 661	-	linker
Val 662	-	linker
Leu 663	-	linker
Phe 664	-	linker
Gln 665	-	linker
Gly 666	-	linker
Pro 667	-	linker
Ala 668	-	linker

A: 669 - 906 (UniProt: P42212)

PDB	External Database	Details
Val 669	Met 1	conflict
Leu 732	Phe 64	conflict
Thr 733	Ser 65	conflict
Lys 874	Ala 206	conflict
Leu 899	His 231	conflict
His 907	-	expression tag
His 908	-	expression tag
His 909	-	expression tag
His 910	-	expression tag
His 911	-	expression tag
His 912	-	expression tag
His 913	-	expression tag
His 914	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	1
	Total formula weight	104527.6
Non-Polymers*	Number of molecules	6
	Total formula weight	2987.3
All*	Total formula weight	107514.9

*Water molecules are not included.